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CHEBI:186057 - S-methylcaptopril

ChEBI IDCHEBI:186057
ChEBI NameS-methylcaptopril
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H17NO3S
Net Charge0
Average Mass231.317
Monoisotopic Mass231.09291
SMILESCSC[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O
InChIInChI=1S/C10H17NO3S/c1-7(6-15-2)9(12)11-5-3-4-8(11)10(13)14/h7-8H,3-6H2,1-2H3,(H,13,14)/t7-,8+/m1/s1
InChIKeyQIAJJGXZCRBHQT-SFYZADRCSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
S-methylcaptopril (CHEBI:186057) is a proline derivative (CHEBI:26273)
IUPAC Name 
(2S)-1-[(2S)-2-methyl-3-methylsulanylpropanoyl]pyrrolidine-2-carboxylic acid
Manual XrefsDatabases
117277ChemSpider
Registry NumbersSources
CAS:78636-29-0ChemIDplus