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CHEBI:234008 - (S)-4-(1-methylpyrrolidin-2-yl)-3-oxobutanoate

Default Structure
ChEBI IDCHEBI:234008
ChEBI Name(S)-4-(1-methylpyrrolidin-2-yl)-3-oxobutanoate
Stars
ASCII Name(S)-4-(1-methylpyrrolidin-2-yl)-3-oxobutanoate
DefinitionMajor species at pH 7.3.
Last Modified26 May 2025
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC9H15NO3
Net Charge0
Average Mass185.223
Monoisotopic Mass185.10519
SMILESC[NH+]1CCC[C@H]1CC(=O)CC(=O)[O-]
InChIInChI=1S/C9H15NO3/c1-10-4-2-3-7(10)5-8(11)6-9(12)13/h7H,2-6H2,1H3,(H,12,13)/t7-/m0/s1
InChIKeyWDFDPXMELFXBFU-ZETCQYMHSA-N
ChEBI Ontology
Outgoing Relation(s)
(S)-4-(1-methylpyrrolidin-2-yl)-3-oxobutanoate (CHEBI:234008) is a 4-(1-methylpyrrolidin-2-yl)-3-oxobutanoate (CHEBI:234325)
UniProt Name  Source
(S)-4-(1-methylpyrrolidin-2-yl)-3-oxobutanoateUniProt
Manual XrefsDatabases
CPD-27773MetaCyc
Citations