CHEBI:135660 - omapatrilat

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ChEBI Name omapatrilat
ChEBI ID CHEBI:135660
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C19H24N2O4S2
Net Charge 0
Average Mass 408.538
Monoisotopic Mass 408.11775
InChI InChI=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
InChIKey LVRLSYPNFFBYCZ-VGWMRTNUSA-N
SMILES C(O)(=O)[C@H]1N2[C@](CCC1)(SCC[C@@H](C2=O)NC([C@H](CC3=CC=CC=C3)S)=O)[H]
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing omapatrilat (CHEBI:135660) is a dipeptide (CHEBI:46761)
Synonym Source
BMS-186716 DrugCentral
Manual Xref Database
1989 DrugCentral
View more database links
Registry Number Type Source
167305-00-2 CAS Registry Number DrugCentral
Last Modified
23 February 2017