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CHEBI:208679 - Chlorostereone

ChEBI IDCHEBI:208679
ChEBI NameChlorostereone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H17ClO3
Net Charge0
Average Mass280.751
Monoisotopic Mass280.08662
SMILESC=C1C(=O)C(Cl)=C2C[C@H]3C[C@](C)(C(=O)O)C[C@H]3[C@]12C
InChIInChI=1S/C15H17ClO3/c1-7-12(17)11(16)9-4-8-5-14(2,13(18)19)6-10(8)15(7,9)3/h8,10H,1,4-6H2,2-3H3,(H,18,19)/t8-,10+,14-,15+/m0/s1
InChIKeyKUFNUUMXIJNLKX-LLQQRXHISA-N
Species of MetaboliteComponentSourceComments
Xeromphalinaspecies (ncbitaxon:2011762) - PubMed (20345148)
ChEBI Ontology
Outgoing Relation(s)
Chlorostereone (CHEBI:208679) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(3aR,3bR,5S,6aR)-1-chloro-3a,5-dimethyl-3-methylidene-2-oxo-4,6,6a,7-tetrahydro-3bH-cyclopenta[a]pentalene-5-carboxylic acid
Manual XrefsDatabases
24528541ChemSpider