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CHEBI:748442 - gemopatrilat

Default Structure
ChEBI IDCHEBI:748442
ChEBI Namegemopatrilat
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC19H26N2O4S
Net Charge0
Average Mass378.494
Monoisotopic Mass378.16133
SMILESCC1(C)CCC[C@H](NC(=O)[C@@H](S)Cc2ccccc2)C(=O)N1CC(=O)O
InChIInChI=1S/C19H26N2O4S/c1-19(2)10-6-9-14(18(25)21(19)12-16(22)23)20-17(24)15(26)11-13-7-4-3-5-8-13/h3-5,7-8,14-15,26H,6,9-12H2,1-2H3,(H,20,24)(H,22,23)/t14-,15-/m0/s1
InChIKeyYRSVDSQRGBYVIY-GJZGRUSLSA-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)
gemopatrilat (CHEBI:748442) is a dipeptide (CHEBI:46761)
INNs  Source
gemopatrilatWHO MedNet
gemopatrilateWHO MedNet
Synonym  Source
BMS-189921ChEMBL
Citations