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CHEBI:746988 - captopril(1-)

Default Structure
ChEBI IDCHEBI:746988
ChEBI Namecaptopril(1-)
Stars
DefinitionMajor species at pH 7.3 (predicted).
Last Modified30 November 2025
SubmitterR. Stephan
DownloadsMolfile
FormulaC9H14NO3S
Net Charge-1
Average Mass216.282
Monoisotopic Mass216.06999
SMILESC[C@H](CS)C(=O)N1CCC[C@H]1C(=O)[O-]
InChIInChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/p-1/t6-,7+/m1/s1
InChIKeyFAKRSMQSSFJEIM-RQJHMYQMSA-M
ChEBI Ontology
Outgoing Relation(s)
captopril(1-) (CHEBI:746988) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
(2S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]pyrrolidine-2-carboxylate