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CHEBI:135660 - omapatrilat

ChEBI IDCHEBI:135660
ChEBI Nameomapatrilat
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC19H24N2O4S2
Net Charge0
Average Mass408.545
Monoisotopic Mass408.11775
SMILES[H][C@]12CCC[C@@H](C(=O)O)N1C(=O)[C@@H](NC(=O)[C@@H](S)Cc1ccccc1)CCS2
InChIInChI=1S/C19H24N2O4S2/c22-17(15(26)11-12-5-2-1-3-6-12)20-13-9-10-27-16-8-4-7-14(19(24)25)21(16)18(13)23/h1-3,5-6,13-16,26H,4,7-11H2,(H,20,22)(H,24,25)/t13-,14-,15-,16-/m0/s1
InChIKeyLVRLSYPNFFBYCZ-VGWMRTNUSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
omapatrilat (CHEBI:135660) is a dipeptide (CHEBI:46761)
Synonym  Source
BMS-186716DrugCentral
Manual XrefsDatabases
1989DrugCentral
Registry NumbersSources
CAS:167305-00-2DrugCentral