EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:197783 - 2alpha,11-dihydroxy-6-oxodrim-7-ene

ChEBI IDCHEBI:197783
ChEBI Name2alpha,11-dihydroxy-6-oxodrim-7-ene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O3
Net Charge0
Average Mass252.354
Monoisotopic Mass252.17254
SMILESCC1=CC(=O)[C@H]2C(C)(C)C[C@H](O)C[C@]2(C)[C@H]1CO
InChIInChI=1S/C15H24O3/c1-9-5-12(18)13-14(2,3)6-10(17)7-15(13,4)11(9)8-16/h5,10-11,13,16-17H,6-8H2,1-4H3/t10-,11-,13-,15+/m0/s1
InChIKeyQXTBAOJTASJFAD-TZQJONAQSA-N
Species of MetaboliteComponentSourceComments
Aspergillus ustus (ncbitaxon:40382) - PubMed (19778087)
ChEBI Ontology
Outgoing Relation(s)
2alpha,11-dihydroxy-6-oxodrim-7-ene (CHEBI:197783) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(4S,4aR,6S,8aS)-6-hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydro-4H-naphthalen-1-one
Manual XrefsDatabases
24665658ChemSpider