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CHEBI:8805 - Repaglinide

ChEBI IDCHEBI:8805
ChEBI NameRepaglinide
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC27H36N2O4
Net Charge0
Average Mass452.595
Monoisotopic Mass452.26751
SMILESCCOc1cc(CC(=O)N[C@@H](CC(C)C)c2ccccc2N2CCCCC2)ccc1C(=O)O
InChIInChI=1S/C27H36N2O4/c1-4-33-25-17-20(12-13-22(25)27(31)32)18-26(30)28-23(16-19(2)3)21-10-6-7-11-24(21)29-14-8-5-9-15-29/h6-7,10-13,17,19,23H,4-5,8-9,14-16,18H2,1-3H3,(H,28,30)(H,31,32)/t23-/m0/s1
InChIKeyFAEKWTJYAYMJKF-QHCPKHFHSA-N
ChEBI Ontology
Outgoing Relation(s)
Repaglinide (CHEBI:8805) is a piperidines (CHEBI:26151)
Synonyms  Source
RepaglinideKEGG COMPOUND
(S)-(+)-RepaglinideDrugCentral
enyglidDrugCentral
surepostDrugCentral
Manual XrefsDatabases
C07670KEGG COMPOUND
D00594KEGG DRUG
LSM-3863LINCS
2366DrugCentral
HMDB0015048HMDB
Registry NumbersSources
CAS:135062-02-1KEGG COMPOUND