EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:223835 - 4alpha,8alpha-dihydroxyeudesman-11-en-1-one

ChEBI IDCHEBI:223835
ChEBI Name4alpha,8alpha-dihydroxyeudesman-11-en-1-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O3
Net Charge0
Average Mass252.354
Monoisotopic Mass252.17254
SMILESC=C(C)[C@H]1C[C@@H]2[C@@](C)(C[C@@H]1O)C(=O)CC[C@@]2(C)O
InChIInChI=1S/C15H24O3/c1-9(2)10-7-12-14(3,8-11(10)16)13(17)5-6-15(12,4)18/h10-12,16,18H,1,5-8H2,2-4H3/t10-,11+,12-,14-,15-/m1/s1
InChIKeyQKRALFPQUVHVEO-BUONHZGMSA-N
Species of MetaboliteComponentSourceComments
Aspergillus flavus (ncbitaxon:5059) - PubMed (31050424)
ChEBI Ontology
Outgoing Relation(s)
4alpha,8alpha-dihydroxyeudesman-11-en-1-one (CHEBI:223835) is a eudesmane sesquiterpenoid (CHEBI:62508)
IUPAC Name 
(4R,4aR,6R,7S,8aR)-4,7-dihydroxy-4,8a-dimethyl-6-prop-1-en-2-yl-3,4a,5,6,7,8-hexahydro-2H-naphthalen-1-one