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The Drug Ontology
Last uploaded:
November 15, 2024
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Preferred Name | Thiothixene | |
Synonyms |
Navane (TN) cis-Thiothixene thiothixene hydrochloride thiothixene HCl Tiotixene Thiothixene |
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ID |
http://purl.obolibrary.org/obo/CHEBI_9571 |
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alternative label |
Navane (TN) cis-Thiothixene thiothixene hydrochloride thiothixene HCl Tiotixene Thiothixene
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charge |
0
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database_cross_reference |
HMDB:HMDB0015560 Drug_Central:2639 CAS:5591-45-7 KEGG:D00374 CAS:3313-26-6
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formula |
C23H29N3O2S2
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has role | ||
has_exact_synonym |
Thiothixene
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has_obo_namespace |
chebi_ontology
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has_related_synonym |
Navane (TN) cis-Thiothixene thiothixene hydrochloride thiothixene HCl Tiotixene
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has_RxCUI |
10510
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id |
CHEBI:9571
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in_subset | ||
inchi |
InChI=1S/C23H29N3O2S2/c1-24(2)30(27,28)18-10-11-23-21(17-18)19(20-7-4-5-9-22(20)29-23)8-6-12-26-15-13-25(3)14-16-26/h4-5,7-11,17H,6,12-16H2,1-3H3/b19-8-
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inchikey |
GFBKORZTTCHDGY-UWVJOHFNSA-N
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label |
Thiothixene
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mass |
443.628
|
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monoisotopicmass |
443.17012
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notation |
CHEBI:9571
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prefLabel |
Thiothixene
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smiles |
CN(C)S(=O)(=O)C1=CC\2=C(SC3=CC=CC=C3/C2=C/CCN4CCN(C)CC4)C=C1
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subClassOf |
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