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CHEBI:215328 - Peaurantiogriseol E

ChEBI IDCHEBI:215328
ChEBI NamePeaurantiogriseol E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H24O3
Net Charge0
Average Mass264.365
Monoisotopic Mass264.17254
SMILESC[C@]12C=C[C@H]3C[C@H](CO)CC[C@H]3[C@@]1(C)C(=O)CCO2
InChIInChI=1S/C16H24O3/c1-15-7-5-12-9-11(10-17)3-4-13(12)16(15,2)14(18)6-8-19-15/h5,7,11-13,17H,3-4,6,8-10H2,1-2H3/t11-,12+,13-,15+,16+/m1/s1
InChIKeyKWZDAZLEQWOPGV-WALBABNVSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (26473887)
ChEBI Ontology
Outgoing Relation(s)
Peaurantiogriseol E (CHEBI:215328) is a organic heterotricyclic compound (CHEBI:26979)
Peaurantiogriseol E (CHEBI:215328) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(4aS,6aR,8R,10aR,10bR)-8-(hydroxymethyl)-4a,10b-dimethyl-2,3,6a,7,8,9,10,10a-octahydrobenzo[]chromen-1-one
Manual XrefsDatabases
40256678ChemSpider