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CHEBI:145218 - 7-hydroxyticlopidine

ChEBI IDCHEBI:145218
ChEBI Name7-hydroxyticlopidine
Stars
DefinitionA thienopyridine that is ticlopidine which carries a hydroxy group at position 7. It is a metabolite of the antiplatelet drug, ticlopidine.
Last Modified7 November 2019
Submittermwilliams
DownloadsMolfile
FormulaC14H14ClNOS
Net Charge0
Average Mass279.792
Monoisotopic Mass279.04846
SMILESOC1CN(Cc2ccccc2Cl)Cc2ccsc21
InChIInChI=1S/C14H14ClNOS/c15-12-4-2-1-3-10(12)7-16-8-11-5-6-18-14(11)13(17)9-16/h1-6,13,17H,7-9H2
InChIKeyGWHGEZHHJDSDMI-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
ChEBI Ontology
Outgoing Relation(s)
7-hydroxyticlopidine (CHEBI:145218) has functional parent ticlopidine (CHEBI:9588)
7-hydroxyticlopidine (CHEBI:145218) has role drug metabolite (CHEBI:49103)
7-hydroxyticlopidine (CHEBI:145218) is a monochlorobenzenes (CHEBI:83403)
7-hydroxyticlopidine (CHEBI:145218) is a organic hydroxy compound (CHEBI:33822)
7-hydroxyticlopidine (CHEBI:145218) is a tertiary amino compound (CHEBI:50996)
7-hydroxyticlopidine (CHEBI:145218) is a thienopyridine (CHEBI:37942)
IUPAC Name 
5-(2-chlorobenzyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-7-ol
Manual XrefsDatabases
HMDB0013921HMDB
Registry NumbersSources
CAS:61923-09-9ChEBI
Citations