CHEBI:212888 - Conocenolide A

ChEBI IDCHEBI:212888
ChEBI NameConocenolide A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESC=C[C@@H]1CC(C)(C)C/C1=C(\CO)[C@H]1COC(=O)C1
InChIInChI=1S/C15H22O3/c1-4-10-6-15(2,3)7-12(10)13(8-16)11-5-14(17)18-9-11/h4,10-11,16H,1,5-9H2,2-3H3/b13-12-/t10-,11-/m1/s1
InChIKeyLRJAOLOLCQHHOR-RPYXHXOLSA-N
Species of MetaboliteComponentSourceComments
Conocybe siliginea (ncbitaxon:373326) - PubMed (17822298)
ChEBI Ontology
Outgoing Relation(s)
Conocenolide A (CHEBI:212888) is a γ-lactone (CHEBI:37581)
IUPAC Name 
(4S)-4-[(1E)-1-[(2S)-2-ethenyl-4,4-dimethylcyclopentylidene]-2-hydroxyethyl]oxolan-2-one
Manual XrefsDatabases
78441121ChemSpider