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CHEBI:220858 - Isopterocarpolone

Default Structure
ChEBI IDCHEBI:220858
ChEBI NameIsopterocarpolone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O2
Net Charge0
Average Mass236.355
Monoisotopic Mass236.17763
SMILESCC1=CC(=O)C[C@]2(C)CC[C@@H](C(C)(C)O)C[C@@H]12
InChIInChI=1S/C15H24O2/c1-10-7-12(16)9-15(4)6-5-11(8-13(10)15)14(2,3)17/h7,11,13,17H,5-6,8-9H2,1-4H3/t11-,13+,15+/m1/s1
InChIKeyFHYDKOXNQTYJEV-ZLDLUXBVSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies RM-14-6 (ncbitaxon:1353416) - PubMed (24237421)
ChEBI Ontology
Outgoing Relation(s)
Isopterocarpolone (CHEBI:220858) is a eudesmane sesquiterpenoid (CHEBI:62508)
IUPAC Name 
(4aR,6R,8aS)-6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-1,4a,5,6,7,8-hexahydronaphthalen-2-one
Manual XrefsDatabases
32033802ChemSpider