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CHEBI:208151 - Phaseolinic acid

ChEBI IDCHEBI:208151
ChEBI NamePhaseolinic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H18O4
Net Charge0
Average Mass214.261
Monoisotopic Mass214.12051
SMILESCCCCC[C@@H]1OC(=O)[C@@H](C)[C@@H]1C(=O)O
InChIInChI=1S/C11H18O4/c1-3-4-5-6-8-9(10(12)13)7(2)11(14)15-8/h7-9H,3-6H2,1-2H3,(H,12,13)/t7-,8-,9-/m0/s1
InChIKeyVRNXAQRALVPTGJ-CIUDSAMLSA-N
Species of MetaboliteComponentSourceComments
Macrophomina phaseolina (ncbitaxon:35725) - DOI (10.1021/np50050a024)
ChEBI Ontology
Outgoing Relation(s)
Phaseolinic acid (CHEBI:208151) is a γ-lactone (CHEBI:37581)
IUPAC Name 
(2S,3S,4S)-4-methyl-5-oxo-2-pentyloxolane-3-carboxylic acid
Manual XrefsDatabases
160088ChemSpider