-
Notifications
You must be signed in to change notification settings - Fork 0
/
Copy pathchemical-substance.ttl
8600 lines (7211 loc) · 826 KB
/
chemical-substance.ttl
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
236
237
238
239
240
241
242
243
244
245
246
247
248
249
250
251
252
253
254
255
256
257
258
259
260
261
262
263
264
265
266
267
268
269
270
271
272
273
274
275
276
277
278
279
280
281
282
283
284
285
286
287
288
289
290
291
292
293
294
295
296
297
298
299
300
301
302
303
304
305
306
307
308
309
310
311
312
313
314
315
316
317
318
319
320
321
322
323
324
325
326
327
328
329
330
331
332
333
334
335
336
337
338
339
340
341
342
343
344
345
346
347
348
349
350
351
352
353
354
355
356
357
358
359
360
361
362
363
364
365
366
367
368
369
370
371
372
373
374
375
376
377
378
379
380
381
382
383
384
385
386
387
388
389
390
391
392
393
394
395
396
397
398
399
400
401
402
403
404
405
406
407
408
409
410
411
412
413
414
415
416
417
418
419
420
421
422
423
424
425
426
427
428
429
430
431
432
433
434
435
436
437
438
439
440
441
442
443
444
445
446
447
448
449
450
451
452
453
454
455
456
457
458
459
460
461
462
463
464
465
466
467
468
469
470
471
472
473
474
475
476
477
478
479
480
481
482
483
484
485
486
487
488
489
490
491
492
493
494
495
496
497
498
499
500
501
502
503
504
505
506
507
508
509
510
511
512
513
514
515
516
517
518
519
520
521
522
523
524
525
526
527
528
529
530
531
532
533
534
535
536
537
538
539
540
541
542
543
544
545
546
547
548
549
550
551
552
553
554
555
556
557
558
559
560
561
562
563
564
565
566
567
568
569
570
571
572
573
574
575
576
577
578
579
580
581
582
583
584
585
586
587
588
589
590
591
592
593
594
595
596
597
598
599
600
601
602
603
604
605
606
607
608
609
610
611
612
613
614
615
616
617
618
619
620
621
622
623
624
625
626
627
628
629
630
631
632
633
634
635
636
637
638
639
640
641
642
643
644
645
646
647
648
649
650
651
652
653
654
655
656
657
658
659
660
661
662
663
664
665
666
667
668
669
670
671
672
673
674
675
676
677
678
679
680
681
682
683
684
685
686
687
688
689
690
691
692
693
694
695
696
697
698
699
700
701
702
703
704
705
706
707
708
709
710
711
712
713
714
715
716
717
718
719
720
721
722
723
724
725
726
727
728
729
730
731
732
733
734
735
736
737
738
739
740
741
742
743
744
745
746
747
748
749
750
751
752
753
754
755
756
757
758
759
760
761
762
763
764
765
766
767
768
769
770
771
772
773
774
775
776
777
778
779
780
781
782
783
784
785
786
787
788
789
790
791
792
793
794
795
796
797
798
799
800
801
802
803
804
805
806
807
808
809
810
811
812
813
814
815
816
817
818
819
820
821
822
823
824
825
826
827
828
829
830
831
832
833
834
835
836
837
838
839
840
841
842
843
844
845
846
847
848
849
850
851
852
853
854
855
856
857
858
859
860
861
862
863
864
865
866
867
868
869
870
871
872
873
874
875
876
877
878
879
880
881
882
883
884
885
886
887
888
889
890
891
892
893
894
895
896
897
898
899
900
901
902
903
904
905
906
907
908
909
910
911
912
913
914
915
916
917
918
919
920
921
922
923
924
925
926
927
928
929
930
931
932
933
934
935
936
937
938
939
940
941
942
943
944
945
946
947
948
949
950
951
952
953
954
955
956
957
958
959
960
961
962
963
964
965
966
967
968
969
970
971
972
973
974
975
976
977
978
979
980
981
982
983
984
985
986
987
988
989
990
991
992
993
994
995
996
997
998
999
1000
@prefix : <https://w3id.org/emmo/domain/chemical-substance#> .
@prefix owl: <http://www.w3.org/2002/07/owl#> .
@prefix rdf: <http://www.w3.org/1999/02/22-rdf-syntax-ns#> .
@prefix xml: <http://www.w3.org/XML/1998/namespace> .
@prefix xsd: <http://www.w3.org/2001/XMLSchema#> .
@prefix bibo: <http://purl.org/ontology/bibo/> .
@prefix emmo: <https://w3id.org/emmo#> .
@prefix foaf: <http://xmlns.com/foaf/0.1/> .
@prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#> .
@prefix skos: <http://www.w3.org/2004/02/skos/core#> .
@prefix vann: <http://purl.org/vocab/vann/> .
@prefix schema: <https://schema.org/> .
@prefix dcterms: <http://purl.org/dc/terms/> .
@prefix annotations: <https://w3id.org/emmo/top/annotations#> .
@base <https://w3id.org/emmo/domain/chemical-substance> .
<https://w3id.org/emmo/domain/chemical-substance> rdf:type owl:Ontology ;
owl:versionIRI <https://w3id.org/emmo/domain/chemical-substance/0.11.0-beta/chemical-substance> ;
owl:imports <https://w3id.org/emmo/1.0.0> ;
dcterms:abstract "This ontology provides terms for chemical substances that can be referenced and re-used other resources."@en ;
dcterms:bibliographicCitation "https://zenodo.org/doi/10.5281/zenodo.10254978" ;
dcterms:contributor <https://orcid.org/0000-0002-1560-809X> ;
dcterms:created "2023-09-28"^^xsd:date ;
dcterms:creator <https://orcid.org/0000-0002-8758-6109> ;
dcterms:issued "2025-02-06"^^xsd:date ;
dcterms:modified "2025-02-06"^^xsd:date ;
dcterms:publisher "EMMO" ;
dcterms:source " " ;
dcterms:title "Chemical Substance Domain Ontology"@en ;
bibo:doi "10.5281/zenodo.10254978" ;
vann:preferredNamespacePrefix "chems" ;
vann:preferredNamespaceUri "https://w3id.org/emmo/domain/chemical-substance" ;
owl:backwardCompatibleWith " " ;
owl:priorVersion "0.10.0-beta" ;
owl:versionInfo "0.11.0-beta" ;
foaf:logo " " .
#################################################################
# Annotation properties
#################################################################
### http://purl.org/dc/terms/bibliographicCitation
dcterms:bibliographicCitation rdf:type owl:AnnotationProperty .
### http://purl.org/dc/terms/created
dcterms:created rdf:type owl:AnnotationProperty .
### http://purl.org/dc/terms/issued
dcterms:issued rdf:type owl:AnnotationProperty .
### http://purl.org/dc/terms/modified
dcterms:modified rdf:type owl:AnnotationProperty .
### http://purl.org/dc/terms/source
dcterms:source rdf:type owl:AnnotationProperty .
### http://purl.org/ontology/bibo/doi
bibo:doi rdf:type owl:AnnotationProperty .
### http://purl.org/vocab/vann/preferredNamespacePrefix
vann:preferredNamespacePrefix rdf:type owl:AnnotationProperty .
### http://purl.org/vocab/vann/preferredNamespaceUri
vann:preferredNamespaceUri rdf:type owl:AnnotationProperty .
### http://www.w3.org/2004/02/skos/core#note
skos:note rdf:type owl:AnnotationProperty ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a general annotation that provides extra context, clarifications, or useful background information"@en .
### https://schema.org/additionalName
schema:additionalName rdf:type owl:AnnotationProperty .
### https://schema.org/familyName
schema:familyName rdf:type owl:AnnotationProperty .
### https://schema.org/givenName
schema:givenName rdf:type owl:AnnotationProperty .
### https://schema.org/name
schema:name rdf:type owl:AnnotationProperty .
### https://w3id.org/emmo#EMMO_0fa6566e_500f_4d24_baa9_b2b22c9a0b72
emmo:EMMO_0fa6566e_500f_4d24_baa9_b2b22c9a0b72 rdf:type owl:AnnotationProperty ;
skos:prefLabel "warning"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "q critical alert about potential dangers, system failures, or serious misuse of a concept."@en ;
rdfs:subPropertyOf skos:note .
### https://w3id.org/emmo#EMMO_32214c66_8bce_40f5_b22d_5059f6cf571b
emmo:EMMO_32214c66_8bce_40f5_b22d_5059f6cf571b rdf:type owl:AnnotationProperty ;
skos:prefLabel "error"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "marks an error or incorrect usage"@en ;
rdfs:subPropertyOf skos:note .
### https://w3id.org/emmo#EMMO_371f5265_fa29_4081_b722_2c530b1fdddb
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb rdf:type owl:AnnotationProperty ;
skos:prefLabel "pubChemReference"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "Pubchem URI for a compound or substance ID."@en ;
rdfs:subPropertyOf rdfs:seeAlso .
### https://w3id.org/emmo#EMMO_4c8480cf_56de_41da_8699_f12a9033313a
emmo:EMMO_4c8480cf_56de_41da_8699_f12a9033313a rdf:type owl:AnnotationProperty ;
skos:prefLabel "important"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "highlights crucial points users must be aware of"@en ;
rdfs:subPropertyOf skos:note .
### https://w3id.org/emmo#EMMO_5f7abc2a_5b50_41c3_8def_c8ba7c3b083e
emmo:EMMO_5f7abc2a_5b50_41c3_8def_c8ba7c3b083e rdf:type owl:AnnotationProperty ;
skos:prefLabel "tip"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a best practice or helpful suggestion related to the concept."@en ;
rdfs:subPropertyOf skos:note .
### https://w3id.org/emmo#EMMO_709ee08d_76b1_4fee_be22_925412ac313b
emmo:EMMO_709ee08d_76b1_4fee_be22_925412ac313b rdf:type owl:AnnotationProperty ;
skos:prefLabel "admonition"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a customized callout for information not covered by default note types"@en ;
rdfs:subPropertyOf skos:note .
### https://w3id.org/emmo#EMMO_95317324_4b53_4665_a087_82c3a2a0540b
emmo:EMMO_95317324_4b53_4665_a087_82c3a2a0540b rdf:type owl:AnnotationProperty ;
skos:prefLabel "danger"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "indicates a serious risk, often safety-related"@en ;
rdfs:subPropertyOf skos:note .
### https://w3id.org/emmo#EMMO_b6730304_cabc_4104_b415_14218466445c
emmo:EMMO_b6730304_cabc_4104_b415_14218466445c rdf:type owl:AnnotationProperty ;
skos:prefLabel "caution"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a moderate-level advisory about possible pitfalls, errors, or inefficiencies"@en ;
rdfs:subPropertyOf skos:note .
### https://w3id.org/emmo#EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 rdf:type owl:AnnotationProperty ;
skos:prefLabel "molecularFormula"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "Corresponds to the molecular formula of the compound."@en ;
rdfs:subPropertyOf rdfs:seeAlso .
### https://w3id.org/emmo#EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba rdf:type owl:AnnotationProperty ;
skos:prefLabel "IUPACName"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "Corresponds to the IUPAC name of the compound."@en ;
rdfs:subPropertyOf rdfs:seeAlso ;
rdfs:range rdf:PlainLiteral .
### https://w3id.org/emmo/domain/chemical-substance#substance_33ab8162_934b_4e36_bb43_5528d867d6d6
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 rdf:type owl:AnnotationProperty ;
skos:prefLabel "standardInChI"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "the value of the standard InChI of a chemical substance"@en ;
rdfs:subPropertyOf rdfs:seeAlso .
### https://w3id.org/emmo/domain/chemical-substance#substance_7fd07cf9_9736_48be_963c_f924ada8ac46
:substance_7fd07cf9_9736_48be_963c_f924ada8ac46 rdf:type owl:AnnotationProperty ;
skos:prefLabel "canonicalSMILES"@en ;
rdfs:subPropertyOf rdfs:seeAlso .
#################################################################
# Object Properties
#################################################################
### https://w3id.org/emmo/domain/electrochemistry#electrochemistry_808e94df_e002_4e64_a6db_182ed75078c6
<https://w3id.org/emmo/domain/electrochemistry#electrochemistry_808e94df_e002_4e64_a6db_182ed75078c6> rdf:type owl:ObjectProperty ;
rdfs:subPropertyOf emmo:EMMO_dba27ca1_33c9_4443_a912_1519ce4c39ec ;
rdfs:domain emmo:EMMO_2031516a_2be7_48e8_9af7_7e1270e308fe ;
rdfs:range emmo:EMMO_e2b11f6a_4191_427e_9844_2e0ac88dfc8b ;
skos:prefLabel "hasSolvent"@en .
### https://w3id.org/emmo/domain/electrochemistry#electrochemistry_8784ef24_320b_4a3d_b200_654aec6c271c
<https://w3id.org/emmo/domain/electrochemistry#electrochemistry_8784ef24_320b_4a3d_b200_654aec6c271c> rdf:type owl:ObjectProperty ;
rdfs:subPropertyOf emmo:EMMO_dba27ca1_33c9_4443_a912_1519ce4c39ec ;
rdfs:domain emmo:EMMO_2031516a_2be7_48e8_9af7_7e1270e308fe ;
rdfs:range emmo:EMMO_e2b11f6a_4191_427e_9844_2e0ac88dfc8b ;
skos:prefLabel "hasSolute"@en .
#################################################################
# Classes
#################################################################
### https://schema.org/Person
schema:Person rdf:type owl:Class ;
skos:prefLabel "Person"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "the schema.org term for a Person"@en .
### https://w3id.org/emmo/domain//chemical-substance#substance_69ce48e4_23e3_4758_84ae_f00ed3f79518
<https://w3id.org/emmo/domain//chemical-substance#substance_69ce48e4_23e3_4758_84ae_f00ed3f79518> rdf:type owl:Class ;
rdfs:subClassOf emmo:EMMO_704630b8_fee3_49b9_baca_40e2dd276370 ;
skos:altLabel "TMSPI"@en ;
skos:prefLabel "TrisTrimethylsilyPhosphite"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q83040831" ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/Tris_trimethylsilyl_-phosphite" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of a phosphate group bonded to three trimethylsilyl groups"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C9H27O3PSi3" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "tris(trimethylsilyl) phosphite" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0001e895_e74b_438f_b47f_b52f33d68331
:substance_0001e895_e74b_438f_b47f_b52f33d68331 rdf:type owl:Class ;
rdfs:subClassOf :substance_fc93282d_cb35_4bab_81a8_78689ae59e5f ;
skos:prefLabel "MagnesiumSaltCompound"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of magnesium cations bonded to anions"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_001ca83b_5372_4d77_a836_4d48074b7e63
:substance_001ca83b_5372_4d77_a836_4d48074b7e63 rdf:type owl:Class ;
rdfs:subClassOf :substance_b474f792_011e_4c9a_8dee_b99d6459cd66 ;
skos:prefLabel "TitaniumOxideCompound"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of titanium and oxygen atoms"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_00db9ba1_7259_4180_a82e_7ed4dafc29a9
:substance_00db9ba1_7259_4180_a82e_7ed4dafc29a9 rdf:type owl:Class ;
rdfs:subClassOf :substance_0001e895_e74b_438f_b47f_b52f33d68331 ;
skos:altLabel "Mg(PF6)2"@en ;
skos:prefLabel "MagnesiumHexafluorophosphate"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of magnesium cations bonded to hexafluorophosphate anions"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_0111ec52_b838_49ab_a24b_884aaa3f54e8
:substance_0111ec52_b838_49ab_a24b_884aaa3f54e8 rdf:type owl:Class ;
rdfs:subClassOf :substance_3540fb20_f719_42eb_ad0c_112ffedb7c6d ;
skos:altLabel "CdO"@en ;
skos:prefLabel "CadmiumOxide"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q196661"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/14782" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of one cadmium and oxygen atom"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "CdO" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Cadmium_oxide"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "oxocadmium" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Cd.O" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0111fe83_2d6c_4df0_9fd3_500ddda7242c
:substance_0111fe83_2d6c_4df0_9fd3_500ddda7242c rdf:type owl:Class ;
rdfs:subClassOf :substance_61c88366_7689_4814_b0c5_1f53aef1eebd ;
skos:prefLabel "GalliumOxideCompound"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of gallium and oxygen atoms"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_012d4091_06bc_4089_bba4_b832200e69cd
:substance_012d4091_06bc_4089_bba4_b832200e69cd rdf:type owl:Class ;
rdfs:subClassOf :substance_0331ffd2_7cb2_40d3_80ce_8b4ab7b3adc5 ;
skos:altLabel "PbCO3"@en ;
skos:prefLabel "LeadIICarbonate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q411260"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/11727" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of lead in the +2 oxidation state bonded to carbonate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "PbCO3" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Lead_carbonate"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "lead(2+);carbonate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/CH2O3.Pb/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0139937b_2724_4864_84fb_f14bcfb83538
:substance_0139937b_2724_4864_84fb_f14bcfb83538 rdf:type owl:Class ;
rdfs:subClassOf :substance_15d08ff9_7685_4020_8481_d9c9b0052176 ;
skos:altLabel "NMO"@en ;
skos:prefLabel "SodiumManganeseOxide"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/129656524" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of sodium, manganese, and oxygen atoms in an oxide structure"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "MnNaO2" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "sodium;oxido(oxo)manganese" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Mn.Na.2O/q;+1;;-1" .
### https://w3id.org/emmo/domain/chemical-substance#substance_015116fe_94ca_4be5_9d14_9d9457a47a72
:substance_015116fe_94ca_4be5_9d14_9d9457a47a72 rdf:type owl:Class ;
rdfs:subClassOf :substance_edae7b22_461b_432b_b737_3c93feb69b0e ;
skos:prefLabel "TransitionMetalSaltCompound"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of transition metal cations bonded to anions"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_0160f86c_e567_40d4_a457_25cf170e7ef2
:substance_0160f86c_e567_40d4_a457_25cf170e7ef2 rdf:type owl:Class ;
rdfs:subClassOf :substance_de2123d1_7ba2_4d3a_837d_a51a5c9170b8 ;
skos:altLabel "NonStoichiometricSiliconOxide"@en ,
"SiOx" ;
skos:prefLabel "SiliconOxide"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q110930085"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of silicon and oxygen atoms"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "SiOx" .
### https://w3id.org/emmo/domain/chemical-substance#substance_02172b42_6e67_439c_93f4_42e7949268ce
:substance_02172b42_6e67_439c_93f4_42e7949268ce rdf:type owl:Class ;
rdfs:subClassOf :substance_584bfc73_2715_417f_973c_552ae58529f5 ;
skos:altLabel "NaTFSI"@en ;
skos:prefLabel "SodiumBistrifluoromethanesulfonylimide"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q114346676"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/11077530" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of sodium cations bonded to bistrifluoromethanesulfonylimide anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C2F6NNaO4S2" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "sodium;bis(trifluoromethylsulfonyl)azanide" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/C2F6NO4S2.Na/c3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;/q-1;+1" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0238c3cb_706f_4c5a_84e3_0738e16264bb
:substance_0238c3cb_706f_4c5a_84e3_0738e16264bb rdf:type owl:Class ;
rdfs:subClassOf :substance_f313522b_e2c4_4251_ba7f_d6b9dc7db1d6 ;
skos:altLabel "Al(ClO3)3"@en ;
skos:prefLabel "AluminiumChlorate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q447553"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/161130" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of aluminium cations bonded to chlorate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "AlCl3O9" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "aluminum;trichlorate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Al.3ClHO3/c;3*2-1(3)4/h;3*(H,2,3,4)/q+3;;;/p-3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_02ec30fa_cbca_4988_8c6b_6ec9f0cd138c
:substance_02ec30fa_cbca_4988_8c6b_6ec9f0cd138c rdf:type owl:Class ;
rdfs:subClassOf :substance_0331ffd2_7cb2_40d3_80ce_8b4ab7b3adc5 ;
skos:altLabel "Pb(OAc)2"@en ;
skos:prefLabel "LeadIIAcetate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q422837"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/9317" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of lead in the +2 oxidation state bonded to acetate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C4H6O4Pb" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Lead(II)_acetate"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "lead(2+);diacetate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/2C2H4O2.Pb/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+2/p-2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_032dde57_9fb4_4cd4_b212_282ff72ea152
:substance_032dde57_9fb4_4cd4_b212_282ff72ea152 rdf:type owl:Class ;
rdfs:subClassOf :substance_b325bdd7_0adf_4522_a4ef_20cd6929e094 ;
skos:altLabel "HCO2H"@en ;
skos:prefLabel "FormicAcid"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q161233"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/284" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of a carboxylic acid group bonded to a hydrogen atom"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "CH2O2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Formic_acid"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "formic acid" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0331ffd2_7cb2_40d3_80ce_8b4ab7b3adc5
:substance_0331ffd2_7cb2_40d3_80ce_8b4ab7b3adc5 rdf:type owl:Class ;
rdfs:subClassOf :substance_015116fe_94ca_4be5_9d14_9d9457a47a72 ;
skos:prefLabel "LeadSaltCompound"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of lead cations bonded to anions"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_0391f63f_9ab8_4b33_a4c5_47591a89de72
:substance_0391f63f_9ab8_4b33_a4c5_47591a89de72 rdf:type owl:Class ;
rdfs:subClassOf :substance_b325bdd7_0adf_4522_a4ef_20cd6929e094 ;
skos:prefLabel "AcrylicAcid"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q324628"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/6581" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound containing a carboxylic acid group and a vinyl group"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C3H4O2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Acrylic_acid"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "prop-2-enoic acid" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)" .
### https://w3id.org/emmo/domain/chemical-substance#substance_046a3fb1_cd54_4014_afd0_908a8ad1da5e
:substance_046a3fb1_cd54_4014_afd0_908a8ad1da5e rdf:type owl:Class ;
rdfs:subClassOf :substance_0f2f65a7_5cc4_4c86_a4d0_676771c646f1 ;
skos:altLabel "GBL"@en ,
"GButyrolactone"@en ;
skos:prefLabel "GammaButyrolactone"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q79739"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/7302" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of a five-membered lactone ring formed from gamma-hydroxybutyric acid"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C4H6O2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Gamma-Butyrolactone"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "oxolan-2-one" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/C4H6O2/c5-4-2-1-3-6-4/h1-3H2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_046acf7e_3390_484c_8c7e_7cf2a331fb3b
:substance_046acf7e_3390_484c_8c7e_7cf2a331fb3b rdf:type owl:Class ;
rdfs:subClassOf :substance_bc76f17d_931a_4728_9663_9f8ed208d5e4 ;
skos:altLabel "CoF2"@en ;
skos:prefLabel "CobaltIIFluoride"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q417121"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/24820" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of cobalt in the +2 oxidation state bonded to fluoride anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "CoF2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Cobalt(II)_fluoride"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "difluorocobalt" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Co.2FH/h;2*1H/q+2;;/p-2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0470d73a_ea51_4505_b164_0c090bf0382b
:substance_0470d73a_ea51_4505_b164_0c090bf0382b rdf:type owl:Class ;
rdfs:subClassOf :substance_f313522b_e2c4_4251_ba7f_d6b9dc7db1d6 ;
skos:altLabel "Al2(CO3)3"@en ;
skos:prefLabel "AluminiumCarbonate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q4737377"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/10353966" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of aluminium cations bonded to carbonate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "Al2(CO3)3" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Aluminium_carbonate"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "dialuminum;tricarbonate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/3CH2O3.2Al/c3*2-1(3)4;;/h3*(H2,2,3,4);;/q;;;2*+3/p-6" .
### https://w3id.org/emmo/domain/chemical-substance#substance_04a7bd93_0a55_444b_a28e_33b01ee0bc4e
:substance_04a7bd93_0a55_444b_a28e_33b01ee0bc4e rdf:type owl:Class ;
rdfs:subClassOf :substance_094f08bc_90ea_4118_b136_47e61e495ab5 ;
skos:altLabel "Cu(NO3)2"@en ;
skos:prefLabel "CopperIINitrate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q286064"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/18616" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of copper in the +2 oxidation state bonded to nitrate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "Cu(NO3)2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Copper(II)_nitrate"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "copper;dinitrate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Cu.2NO3/c;2*2-1(3)4/q+2;2*-1" .
### https://w3id.org/emmo/domain/chemical-substance#substance_04ad7fec_b260_4d25_9c6e_47711c0f8a46
:substance_04ad7fec_b260_4d25_9c6e_47711c0f8a46 rdf:type owl:Class ;
rdfs:subClassOf :substance_7fd3843d_f0b7_4490_bcf3_519fb9e2b150 ;
skos:altLabel "2MethoxyethylMethylCarbonate"@en ;
skos:prefLabel "MOEMC"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "http://127.0.0.1:5000/compounds/23290296"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/23290296" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of a carbonate group bonded to a 2-methoxyethyl group and a methyl group"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C5H10O4" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "2-methoxyethyl methyl carbonate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/C5H10O4/c1-7-3-4-9-5(6)8-2/h3-4H2,1-2H3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_05b11934_6a3e_4434_855b_111aced0a6be
:substance_05b11934_6a3e_4434_855b_111aced0a6be rdf:type owl:Class ;
rdfs:subClassOf :substance_7dd5ebb3_1084_485a_9fbf_05954cd2da84 ;
skos:altLabel "Ba(TFSI)2"@en ;
skos:prefLabel "BariumBistrifluoromethanesulfonylimide"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of barium cations bonded to bistrifluoromethanesulfonylimide anions"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_08695cfe_3dfa_4b17_9f09_13e6f90e3875
:substance_08695cfe_3dfa_4b17_9f09_13e6f90e3875 rdf:type owl:Class ;
rdfs:subClassOf :substance_bc76f17d_931a_4728_9663_9f8ed208d5e4 ;
skos:altLabel "Co(NO2)2"@en ;
skos:prefLabel "CobaltIINitrite"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/101611500" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of cobalt in the +2 oxidation state bonded to nitrite anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "CoN2O4" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "cobalt(2+);dinitrite" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Co.2HNO2/c;2*2-1-3/h;2*(H,2,3)/q+2;;/p-2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_09338922_833a_406c_be2c_4098980cabc3
:substance_09338922_833a_406c_be2c_4098980cabc3 rdf:type owl:Class ;
rdfs:subClassOf :substance_92667c34_98eb_4bc9_a0d4_6dd44e5b287a ;
skos:altLabel "InBr3"@en ;
skos:prefLabel "IndiumIIIBromide"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q4096881"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/26046" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of indium in the +3 oxidation state bonded to bromide anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "Br3In" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Indium(III)_bromide"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "tribromoindigane" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/3BrH.In/h3*1H;/q;;;+3/p-3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_094f08bc_90ea_4118_b136_47e61e495ab5
:substance_094f08bc_90ea_4118_b136_47e61e495ab5 rdf:type owl:Class ;
rdfs:subClassOf :substance_015116fe_94ca_4be5_9d14_9d9457a47a72 ;
skos:prefLabel "CopperSaltCompound"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of copper cations bonded to anions"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_0952b0ae_0067_4b42_812a_abb68c95a6f8
:substance_0952b0ae_0067_4b42_812a_abb68c95a6f8 rdf:type owl:Class ;
rdfs:subClassOf :substance_c12c3203_9d18_4a69_8a10_25b100ff48c8 ;
skos:altLabel "Ca(OTf)2"@en ;
skos:prefLabel "CalciumTriflate"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/2734307" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of calcium cations bonded to triflate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C2CaF6O6S2" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "calcium;trifluoromethanesulfonate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/2CHF3O3S.Ca/c2*2-1(3,4)8(5,6)7;/h2*(H,5,6,7);/q;;+2/p-2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0993cbab_ff7f_4ec3_8a6c_cd67497d54d9
:substance_0993cbab_ff7f_4ec3_8a6c_cd67497d54d9 rdf:type owl:Class ;
rdfs:subClassOf emmo:EMMO_436b11bd_1756_4821_9f14_c9ed6b67552e ,
:substance_2fc3e95b_6f48_47ea_a366_bcc26336239a ;
skos:prefLabel "Copper"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q753"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/23978" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical substance consisting of the transition metal copper in its elemental form"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "Cu" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Copper"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "copper" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Cu" .
### https://w3id.org/emmo/domain/chemical-substance#substance_09aa1409_b244_4d5e_a6ed_c94bdff60e42
:substance_09aa1409_b244_4d5e_a6ed_c94bdff60e42 rdf:type owl:Class ;
rdfs:subClassOf :substance_cb6d2c65_9977_4bb1_987a_5ea828de445f ;
skos:altLabel "Mn(ClO3)2"@en ;
skos:prefLabel "ManganeseIIChlorate"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of manganese in the +2 oxidation state bonded to chlorate anions"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_09c627db_bca7_4a25_9233_90af4e22505e
:substance_09c627db_bca7_4a25_9233_90af4e22505e rdf:type owl:Class ;
rdfs:subClassOf :substance_878a0e2f_12ba_484e_8197_75e57139d207 ,
:substance_961f7671_8708_4ce3_9c7d_79444adba9c0 ;
skos:altLabel "MeOH"@en ;
skos:prefLabel "Methanol"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q14982"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/887" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of a hydroxyl group bonded to a methyl group"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "CH4O" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Methanol"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "methanol" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/CH4O/c1-2/h2H,1H3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_09e14ca2_f909_40cc_ba93_e1a149938abc
:substance_09e14ca2_f909_40cc_ba93_e1a149938abc rdf:type owl:Class ;
rdfs:subClassOf :substance_bed1a22c_8b61_467a_86a0_d24c7b910653 ;
skos:altLabel "Ca(OH)2"@en ;
skos:prefLabel "CalciumHydroxide"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q182849"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/6093208" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of calcium and hydroxide ions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "Ca(OH)2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Calcium_hydroxide"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "calcium;dihydroxide" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Ca.2H2O/h;2*1H2/q+2;;/p-2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_09e44ba7_e928_4aa8_aa50_484742e6965c
:substance_09e44ba7_e928_4aa8_aa50_484742e6965c rdf:type owl:Class ;
rdfs:subClassOf :substance_92667c34_98eb_4bc9_a0d4_6dd44e5b287a ;
skos:altLabel "In(BF4)3"@en ;
skos:prefLabel "IndiumIIITetrafluoroborate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q72482882"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/168726" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of indium in the +3 oxidation state bonded to tetrafluoroborate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "B3F12In" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "indium(3+);tritetrafluoroborate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/3BF4.In/c3*2-1(3,4)5;/q3*-1;+3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0a5cb747_60cf_4929_a54a_712c54b49f3b
:substance_0a5cb747_60cf_4929_a54a_712c54b49f3b rdf:type owl:Class ;
rdfs:subClassOf :substance_6c0cc397_d8c4_4473_a09f_1e5de568e0dd ;
skos:prefLabel "CarbonBlack"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q764245"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical substance consisting of finely divided amorphous carbon"@en ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Carbon_black"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_0a6ddace_69a9_43af_8cb1_bf1fcfaaea67
:substance_0a6ddace_69a9_43af_8cb1_bf1fcfaaea67 rdf:type owl:Class ;
rdfs:subClassOf :substance_584bfc73_2715_417f_973c_552ae58529f5 ;
skos:altLabel "NaBOP"@en ;
skos:prefLabel "SodiumBisoxalatophosphate"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of sodium cations bonded to bisoxalatophosphate anions"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_0aae472b_b322_43c4_991f_e4ec88f52f3e
:substance_0aae472b_b322_43c4_991f_e4ec88f52f3e rdf:type owl:Class ;
rdfs:subClassOf :substance_92667c34_98eb_4bc9_a0d4_6dd44e5b287a ;
skos:altLabel "In(OTf)2"@en ;
skos:prefLabel "IndiumIIITriflate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q72482889"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/2734680" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of indium in the +3 oxidation state bonded to triflate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C3F9InO9S3" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "indium(3+);trifluoromethanesulfonate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/3CHF3O3S.In/c3*2-1(3,4)8(5,6)7;/h3*(H,5,6,7);/q;;;+3/p-3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0bdf0bb9_41fc_455d_af11_a249e24acdf6
:substance_0bdf0bb9_41fc_455d_af11_a249e24acdf6 rdf:type owl:Class ;
rdfs:subClassOf :substance_15d08ff9_7685_4020_8481_d9c9b0052176 ;
skos:prefLabel "SodiumCobaltPhosphate"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/13710615" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of sodium, cobalt, phosphate, and oxygen atoms"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "CoNaO4P" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "sodium;cobalt(2+);phosphate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Co.Na.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4)/q+2;+1;/p-3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0dcf209c_6455_4305_9714_fec548742c6a
:substance_0dcf209c_6455_4305_9714_fec548742c6a rdf:type owl:Class ;
rdfs:subClassOf :substance_b474f792_011e_4c9a_8dee_b99d6459cd66 ;
skos:prefLabel "PalladiumOxideCompound"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of palladium and oxygen atoms"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_0deb4fe8_b0c0_4e3f_8848_64435e5c0771
:substance_0deb4fe8_b0c0_4e3f_8848_64435e5c0771 rdf:type owl:Class ;
rdfs:subClassOf :substance_4744a12c_ca28_46b4_9e59_43c1cc15b536 ;
skos:altLabel "LiPF6"@en ;
skos:prefLabel "LithiumHexafluorophosphate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q2583808"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/23688915" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of lithium cations bonded to hexafluorophosphate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "LiPF6" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Lithium_hexafluorophosphate"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "lithium;hexafluorophosphate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/F6P.Li/c1-7(2,3,4,5)6;/q-1;+1" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0e21b44e_5749_4b19_9d79_d8b70df1cdc6
:substance_0e21b44e_5749_4b19_9d79_d8b70df1cdc6 rdf:type owl:Class ;
rdfs:subClassOf :substance_de038959_9251_48d1_a141_3684f14d957f ;
skos:altLabel "Al(OH)3"@en ;
skos:prefLabel "AluminiumHydroxide"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q407125"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/10176082" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of aluminium atoms bonded to hydroxide groups"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "AlH3O3" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Aluminium_hydroxide"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "aluminum;trihydroxide" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Al.3H2O/h;3*1H2/q+3;;;/p-3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0e235e95_739d_443a_ad4b_97ef1edb9c89
:substance_0e235e95_739d_443a_ad4b_97ef1edb9c89 rdf:type owl:Class ;
rdfs:subClassOf :substance_0f2f65a7_5cc4_4c86_a4d0_676771c646f1 ;
skos:altLabel "DOL"@en ;
skos:prefLabel "Dioxolane"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q2234483"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/12586" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of a five-membered cyclic ether with two oxygen atoms in the ring"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C3H6O2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Dioxolane"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "1,3-dioxolane" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/C3H6O2/c1-2-5-3-4-1/h1-3H2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0f29d712_f329_4b17_abeb_5df9bf4fb321
:substance_0f29d712_f329_4b17_abeb_5df9bf4fb321 rdf:type owl:Class ;
rdfs:subClassOf emmo:EMMO_436b11bd_1756_4821_9f14_c9ed6b67552e ,
:substance_2fc3e95b_6f48_47ea_a366_bcc26336239a ;
skos:prefLabel "Technetium"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q1054"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/23957" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical substance consisting of the transition metal technetium in its elemental form"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "Tc" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Technetium"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "technetium" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Tc" .
### https://w3id.org/emmo/domain/chemical-substance#substance_0f2f65a7_5cc4_4c86_a4d0_676771c646f1
:substance_0f2f65a7_5cc4_4c86_a4d0_676771c646f1 rdf:type owl:Class ;
rdfs:subClassOf emmo:EMMO_e2b11f6a_4191_427e_9844_2e0ac88dfc8b ;
skos:prefLabel "Solvent" ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q146505" ;
emmo:EMMO_50c298c2_55a2_4068_b3ac_4e948c33181f "https://www.electropedia.org/iev/iev.nsf/display?openform&ievref=114-01-06" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a substance into which another substance is dissolved"@en ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Solvent"@en .
[ rdf:type owl:Axiom ;
owl:annotatedSource :substance_0f2f65a7_5cc4_4c86_a4d0_676771c646f1 ;
owl:annotatedProperty emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 ;
owl:annotatedTarget "a substance into which another substance is dissolved"@en ;
dcterms:source "International Electrotechnical Commission (IEC), IEC 60050 - International Electrotechnical Vocabulary, retrieved from: https://www.electropedia.org"
] .
### https://w3id.org/emmo/domain/chemical-substance#substance_1285bd02_b0c1_45cb_8895_6ae6517f86a1
:substance_1285bd02_b0c1_45cb_8895_6ae6517f86a1 rdf:type owl:Class ;
rdfs:subClassOf :substance_b325bdd7_0adf_4522_a4ef_20cd6929e094 ;
skos:prefLabel "PropionicAcid"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q422956"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/1032" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of a carboxylic acid group bonded to a propyl group"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C3H6O2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Propionic_acid"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "propanoic acid" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/C3H6O2/c1-2-3(4)5/h2H2,1H3,(H,4,5)" .
### https://w3id.org/emmo/domain/chemical-substance#substance_12f3fc79_fc8f_44a1_8736_945e03392abe
:substance_12f3fc79_fc8f_44a1_8736_945e03392abe rdf:type owl:Class ;
rdfs:subClassOf :substance_dce90b66_3414_4f5d_b818_4a0e4339e949 ;
skos:altLabel "Ni(TFSI)2"@en ;
skos:prefLabel "NickelIIBistrifluoromethanesulfonylimide"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/15976041" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of nickel in the +2 oxidation state bonded to bistrifluoromethanesulfonylimide anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C4F12N2NiO8S4" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "bis(trifluoromethylsulfonyl)azanide;nickel(2+)" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/2C2F6NO4S2.Ni/c2*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;/q2*-1;+2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_13eaf787_000e_44f8_b939_332101e81dd2
:substance_13eaf787_000e_44f8_b939_332101e81dd2 rdf:type owl:Class ;
rdfs:subClassOf :substance_094f08bc_90ea_4118_b136_47e61e495ab5 ;
skos:altLabel "Cu3(PO4)2"@en ;
skos:prefLabel "CopperIIPhosphate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q60568753"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/86469" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of copper in the +2 oxidation state bonded to phosphate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "Cu3(PO4)2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Copper(II)_phosphate"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "tricopper;diphosphate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/3Cu.2H3O4P/c;;;2*1-5(2,3)4/h;;;2*(H3,1,2,3,4)/q3*+2;;/p-6" .
### https://w3id.org/emmo/domain/chemical-substance#substance_155e894b_66de_4cda_9dbe_adbeca7d8102
:substance_155e894b_66de_4cda_9dbe_adbeca7d8102 rdf:type owl:Class ;
rdfs:subClassOf :substance_b474f792_011e_4c9a_8dee_b99d6459cd66 ;
skos:prefLabel "TinOxideCompound"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of tin and oxygen atoms"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_15d08ff9_7685_4020_8481_d9c9b0052176
:substance_15d08ff9_7685_4020_8481_d9c9b0052176 rdf:type owl:Class ;
rdfs:subClassOf emmo:EMMO_4e659c69_ca2d_4569_8a96_f99857a1fa32 ;
skos:prefLabel "MixedMetalOxideCompound"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of a combination of metal oxides"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_16864b33_aa8e_451d_ad8e_b0af5f18769a
:substance_16864b33_aa8e_451d_ad8e_b0af5f18769a rdf:type owl:Class ;
rdfs:subClassOf :substance_7fd3843d_f0b7_4490_bcf3_519fb9e2b150 ;
owl:deprecated "true"^^xsd:boolean ;
skos:altLabel "Oxolane"@en ,
"THF"@en ;
skos:prefLabel "Tetrahydrofuran"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q278332"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/8028" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of a five-membered cyclic ether"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C4H8O" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Tetrahydrofuran"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "oxolane" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/C4H8O/c1-2-4-5-3-1/h1-4H2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_16d7c7a6_56ef_429b_9ce8_cd911410d083
:substance_16d7c7a6_56ef_429b_9ce8_cd911410d083 rdf:type owl:Class ;
rdfs:subClassOf :substance_7dd5ebb3_1084_485a_9fbf_05954cd2da84 ;
skos:altLabel "Ba(BF4)2"@en ;
skos:prefLabel "BariumTetrafluoroborate"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/203099" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of barium cations bonded to tetrafluoroborate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "B2BaF8" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "barium(2+);ditetrafluoroborate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/2BF4.Ba/c2*2-1(3,4)5;/q2*-1;+2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_177b95f8_2816_43de_94bb_1a1054c45e32
:substance_177b95f8_2816_43de_94bb_1a1054c45e32 rdf:type owl:Class ;
rdfs:subClassOf :substance_8e5448fc_1916_4afb_9fd9_2489797f6922 ;
skos:altLabel "OH"@en ;
skos:prefLabel "ZincHydroxide"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q204820"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/substance/319339263" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of zinc and hydroxide ions"@en ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Zinc_hydroxide"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_17c30663_ccc8_45b0_b713_9bd095e20ebd
:substance_17c30663_ccc8_45b0_b713_9bd095e20ebd rdf:type owl:Class ;
rdfs:subClassOf :substance_92667c34_98eb_4bc9_a0d4_6dd44e5b287a ;
skos:altLabel "In(ClO4)3"@en ;
skos:prefLabel "IndiumIIIPerchlorate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q15628085"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/11212117" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of indium in the +3 oxidation state bonded to perchlorate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "Cl3InO12" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Indium_perchlorate"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "indium(3+);triperchlorate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/3ClHO4.In/c3*2-1(3,4)5;/h3*(H,2,3,4,5);/q;;;+3/p-3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_191c3c02_4930_44d4_bf20_0d79ed41f8c5
:substance_191c3c02_4930_44d4_bf20_0d79ed41f8c5 rdf:type owl:Class ;
rdfs:subClassOf :substance_bc76f17d_931a_4728_9663_9f8ed208d5e4 ;
skos:altLabel "CoSO3"@en ;
skos:prefLabel "CobaltIISulfite"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/18760923" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of cobalt in the +2 oxidation state bonded to sulfite anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "CoO3S" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://www.wikidata.org/wiki/Q16326547"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "cobalt(2+);sulfite" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Co.H2O3S/c;1-4(2)3/h;(H2,1,2,3)/q+2;/p-2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_19292fbf_8a09_45a0_b807_f643253a333c
:substance_19292fbf_8a09_45a0_b807_f643253a333c rdf:type owl:Class ;
rdfs:subClassOf :substance_f5b930f9_2f95_4268_993c_ff6b57ae7691 ;
skos:altLabel "HClO3"@en ;
skos:prefLabel "ChloricAcid"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q138809"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/19654" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of chlorine and oxygen atoms bonded to a hydroxyl group"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "ClHO3" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Chloric_acid"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "chloric acid" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/ClHO3/c2-1(3)4/h(H,2,3,4)" .
### https://w3id.org/emmo/domain/chemical-substance#substance_1988f19c_c06b_44ab_817e_dd23b9dfd9d5
:substance_1988f19c_c06b_44ab_817e_dd23b9dfd9d5 rdf:type owl:Class ;
rdfs:subClassOf :substance_0111fe83_2d6c_4df0_9fd3_500ddda7242c ;
skos:altLabel "Ga2O3"@en ;
skos:prefLabel "GalliumOxide"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q419487"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/158605" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of gallium in the +3 oxidaiton state and oxygen atoms"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "Ga2O3" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Gallium(III)_oxide"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "digallium;oxygen(2-)" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/2Ga.3O/q2*+3;3*-2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_19f88cb6_57a8_4111_9d73_6b58dce0ba76
:substance_19f88cb6_57a8_4111_9d73_6b58dce0ba76 rdf:type owl:Class ;
rdfs:subClassOf :substance_b07a5287_67d1_4f4f_9640_e0146f713a6c ;
skos:altLabel "Zn(CN)2"@en ;
skos:prefLabel "ZincCyanide"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q204713"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/11186" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of zinc cations bonded to cyanide anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "Zn(CN)2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Zinc_cyanide"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "zinc;dicyanide" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/2CN.Zn/c2*1-2;/q2*-1;+2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_1b31f3bb_1c1b_40e2_8d0f_0e21abe237e7
:substance_1b31f3bb_1c1b_40e2_8d0f_0e21abe237e7 rdf:type owl:Class ;
rdfs:subClassOf :substance_f313522b_e2c4_4251_ba7f_d6b9dc7db1d6 ;
skos:altLabel "Al(OAc)3"@en ;
skos:prefLabel "AluminiumAcetate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q27861942"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/8757" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of aluminium cations bonded to acetate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C6H9AlO6" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Aluminium_triacetate"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "aluminum;triacetate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/3C2H4O2.Al/c3*1-2(3)4;/h3*1H3,(H,3,4);/q;;;+3/p-3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_1be34841_81f7_4216_8290_6bd75361a1c9
:substance_1be34841_81f7_4216_8290_6bd75361a1c9 rdf:type owl:Class ;
rdfs:subClassOf :substance_584bfc73_2715_417f_973c_552ae58529f5 ;
skos:altLabel "NaTFOB"@en ;
skos:prefLabel "SodiumTrifluoromethanesulfonyloxalatoborate"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of sodium cations bonded to trifluoromethanesulfonyl oxalatoborate anions"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_1c24293c_3a09_4084_a6bb_0db9fae5e786
:substance_1c24293c_3a09_4084_a6bb_0db9fae5e786 rdf:type owl:Class ;
rdfs:subClassOf emmo:EMMO_704630b8_fee3_49b9_baca_40e2dd276370 ;
skos:altLabel "TTFEB"@en ;
skos:prefLabel "Tris222TrifluoroethylBorate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q28457468"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/3599767" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of a borate group bonded to three trifluoroethyl groups"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C6H6BF9O3" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Tris(2,2,2-trifluoroethyl)_borate"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "tris(2,2,2-trifluoroethyl) borate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/C6H6BF9O3/c8-4(9,10)1-17-7(18-2-5(11,12)13)19-3-6(14,15)16/h1-3H2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_1d8e9a99_b998_47e6_98a7_a6efd8dab9ce
:substance_1d8e9a99_b998_47e6_98a7_a6efd8dab9ce rdf:type owl:Class ;
rdfs:subClassOf :substance_6c0cc397_d8c4_4473_a09f_1e5de568e0dd ;
skos:altLabel "CO2"@en ;
skos:prefLabel "CarbonDioxide"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q1997"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/280" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of one carbon atom double-bonded to two oxygen atoms"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "CO2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Carbon_dioxide"@en ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/CO2/c2-1-3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_1dd8fd65_919b_40d1_a78c_9409b28e323e
:substance_1dd8fd65_919b_40d1_a78c_9409b28e323e rdf:type owl:Class ;
rdfs:subClassOf :substance_5a5e8609_83bf_46d1_a1b0_eaafa27aaed4 ;
skos:altLabel "MA"@en ,
"MeOAc"@en ,
"MethylEthanoate"@en ;
skos:prefLabel "MethylAcetate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q414189"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/6584" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound containing a methyl group bonded to an acetate functional group"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C3H6O2" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Methyl_acetate"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "methyl acetate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3" .
### https://w3id.org/emmo/domain/chemical-substance#substance_1dfa4556_49d2_494c_971d_bd193219e9b2
:substance_1dfa4556_49d2_494c_971d_bd193219e9b2 rdf:type owl:Class ;
rdfs:subClassOf :substance_dce90b66_3414_4f5d_b818_4a0e4339e949 ;
skos:altLabel "NiSO4"@en ;
skos:prefLabel "NickelIISulfate"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q411337"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/24586" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of nickel in the +2 oxidation state bonded to sulfate anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "NiSO4" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Nickel(II)_sulfate"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "nickel(2+);sulfate" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/Ni.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_1e30dcc6_b1c7_4fe9_8f36_1dd427c78a93
:substance_1e30dcc6_b1c7_4fe9_8f36_1dd427c78a93 rdf:type owl:Class ;
rdfs:subClassOf :substance_b07a5287_67d1_4f4f_9640_e0146f713a6c ;
skos:altLabel "ZnSO3"@en ;
skos:prefLabel "ZincSulfite"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q20670642"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/159685" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of zinc cations bonded to sulfite anions"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "ZnSO3" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "zinc;sulfite" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/H2O3S.Zn/c1-4(2)3;/h(H2,1,2,3);/q;+2/p-2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_1e5c69b2_6dac_44b6_a24e_6170b516cf2c
:substance_1e5c69b2_6dac_44b6_a24e_6170b516cf2c rdf:type owl:Class ;
rdfs:subClassOf :substance_c12c3203_9d18_4a69_8a10_25b100ff48c8 ;
skos:altLabel "Ca(BOP)2"@en ;
skos:prefLabel "CalciumBisoxalatophosphate"@en ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of calcium cations bonded to bisoxalatophosphate anions"@en .
### https://w3id.org/emmo/domain/chemical-substance#substance_20004d19_02cf_4667_a09f_b5c595b44b1f
:substance_20004d19_02cf_4667_a09f_b5c595b44b1f rdf:type owl:Class ;
rdfs:subClassOf :substance_7fd3843d_f0b7_4490_bcf3_519fb9e2b150 ;
skos:altLabel "FEC"@en ;
skos:prefLabel "FluoroethyleneCarbonate"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/2769656" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical compound consisting of a cyclic carbonate structure with a fluorine atom substituted on the ethylene group"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C3H3FO3" ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "4-fluoro-1,3-dioxolan-2-one" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/C3H3FO3/c4-2-1-6-3(5)7-2/h2H,1H2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_20319b23_0673_45de_9b12_794813d948a9
:substance_20319b23_0673_45de_9b12_794813d948a9 rdf:type owl:Class ;
rdfs:subClassOf emmo:EMMO_436b11bd_1756_4821_9f14_c9ed6b67552e ,
:substance_a9a6507f_9c61_44d3_bd86_f1ebf763e150 ;
skos:prefLabel "Arsenic"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q871"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/5359596" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a chemical substance consisting of the metalloid arsenic in its elemental form"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "As" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Arsenic"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "arsenic" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/As" .
### https://w3id.org/emmo/domain/chemical-substance#substance_210edf30_ad63_438c_97db_f817942db49b
:substance_210edf30_ad63_438c_97db_f817942db49b rdf:type owl:Class ;
rdfs:subClassOf :substance_7e716191_b301_4d63_bb6b_93323ffe51bf ;
skos:altLabel "SBR"@en ;
skos:prefLabel "StyreneButadiene"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q146429"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/62697" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "a polymer consisting of styrene and butadiene monomers"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C12H14" ;
emmo:EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d "https://en.wikipedia.org/wiki/Styrene-butadiene"@en ;
emmo:EMMO_f652e7d2_0b33_4d10_8d0f_2f70089982ba "buta-1,3-diene;styrene" ;
:substance_33ab8162_934b_4e36_bb43_5528d867d6d6 "InChI=1S/C8H8.C4H6/c1-2-8-6-4-3-5-7-8;1-3-4-2/h2-7H,1H2;3-4H,1-2H2" .
### https://w3id.org/emmo/domain/chemical-substance#substance_21954b0b_c05c_42db_b276_3a931d8aabb1
:substance_21954b0b_c05c_42db_b276_3a931d8aabb1 rdf:type owl:Class ;
rdfs:subClassOf :substance_7fd3843d_f0b7_4490_bcf3_519fb9e2b150 ;
skos:altLabel "DMM"@en ,
"Methylal"@en ;
skos:prefLabel "Dimethoxymethane"@en ;
emmo:EMMO_26bf1bef_d192_4da6_b0eb_d2209698fb54 "https://www.wikidata.org/wiki/Q411496"@en ;
emmo:EMMO_371f5265_fa29_4081_b722_2c530b1fdddb "https://pubchem.ncbi.nlm.nih.gov/compound/8020" ;
emmo:EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9 "an acetal that is the dimethyl acetal derivative of formaldehyde"@en ;
emmo:EMMO_b8c10b72_7cc1_4e82_b4ab_728faf504919 "C3H8O2" ;