CHEBI:208619 - Penicilactone A

ChEBI IDCHEBI:208619
ChEBI NamePenicilactone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H16O4
Net Charge0
Average Mass212.245
Monoisotopic Mass212.10486
SMILESCCCC1=C/C(=C/[C@H](O)[C@H](C)O)OC1=O
InChIInChI=1S/C11H16O4/c1-3-4-8-5-9(15-11(8)14)6-10(13)7(2)12/h5-7,10,12-13H,3-4H2,1-2H3/b9-6-/t7-,10-/m0/s1
InChIKeyUBKACRCUIDSXLA-UAADGWBESA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073)
- PubMed (31344841)
- PubMed (31817515)
ChEBI Ontology
Outgoing Relation(s)
Penicilactone A (CHEBI:208619) is a butenolide (CHEBI:50523)
IUPAC Names 
(5Z)-5-[(2S,3S)-2,3-dihydroxybutylidene]-3-propyluran-2-one
(3-hydroxy-5-methylphenyl) 2-[(2S)-2-hydroxy-4-methyl-5-oxouran-2-yl]acetate
Manual XrefsDatabases
77005948ChemSpider
81131520ChemSpider