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Biological and Environmental Research Ontology
Last uploaded:
December 23, 2022
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| Preferred Name | tolvaptan | |
| Synonyms |
OPC 41061 OPC-41061 jinarc samsca tolvaptan N-[4-(7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carbonyl)-3-methylphenyl]-2-methylbenzamide Tolvaptan |
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| Definitions |
A benzazepine derivative incorporating a benzenedicarboxamide function whch is a selective vasopressin V2 receptor antagonist used to treat euvolemic and hypervolemic hyponatremia. It is also used in the treatment of rapidly progressing autosomal dominant polycystic kidney disease to slow the rate of cyst development and renal insufficiency. Tolvaptan is a racemate consisting of a 1:1 mixture of 5R and 5S stereomers. |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_32246 |
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| alternative term |
OPC 41061 OPC-41061 jinarc samsca tolvaptan N-[4-(7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carbonyl)-3-methylphenyl]-2-methylbenzamide Tolvaptan
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| bearer of | ||
| charge |
0
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| database_cross_reference |
PMID:34386666 PMID:12742979 PMID:34476570 Drug_Central:4110 PMID:34526469 KEGG:C12613 PMID:16211205 KEGG:D01213 PMID:34514204 PMID:33078835 Wikipedia:Tolvaptan PMID:34554640 CAS:150683-30-0 PMID:34070416
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|
| definition |
A benzazepine derivative incorporating a benzenedicarboxamide function whch is a selective vasopressin V2 receptor antagonist used to treat euvolemic and hypervolemic hyponatremia. It is also used in the treatment of rapidly progressing autosomal dominant polycystic kidney disease to slow the rate of cyst development and renal insufficiency. Tolvaptan is a racemate consisting of a 1:1 mixture of 5R and 5S stereomers.
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| formula |
C26H25ClN2O3
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| has_exact_synonym |
N-[4-(7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carbonyl)-3-methylphenyl]-2-methylbenzamide Tolvaptan
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| has_obo_namespace |
chebi_ontology
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| has_related_synonym |
OPC 41061 OPC-41061 jinarc samsca tolvaptan
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| id |
CHEBI:32246
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| in_subset | ||
| inchi |
InChI=1S/C26H25ClN2O3/c1-16-6-3-4-7-20(16)25(31)28-19-10-11-21(17(2)14-19)26(32)29-13-5-8-24(30)22-15-18(27)9-12-23(22)29/h3-4,6-7,9-12,14-15,24,30H,5,8,13H2,1-2H3,(H,28,31)
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| inchikey |
GYHCTFXIZSNGJT-UHFFFAOYSA-N
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| label |
tolvaptan
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|
| mass |
448.950
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| monoisotopicmass |
448.15537
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| notation |
CHEBI:32246
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| prefLabel |
tolvaptan
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| RO_0000087 | ||
| smiles |
CC1=CC=CC=C1C(=O)NC1=CC(C)=C(C=C1)C(=O)N1CCCC(O)C2=CC(Cl)=CC=C12
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| subClassOf |
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