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CHEBI:204558 - (3R,6R)-dihydroxy-9,7(11)-dien-8-oxoeremophilane

ChEBI IDCHEBI:204558
ChEBI Name(3R,6R)-dihydroxy-9,7(11)-dien-8-oxoeremophilane
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESCC(C)=C1C(=O)C=C2CC[C@@H](O)[C@H](C)[C@@]2(C)[C@H]1O
InChIInChI=1S/C15H22O3/c1-8(2)13-12(17)7-10-5-6-11(16)9(3)15(10,4)14(13)18/h7,9,11,14,16,18H,5-6H2,1-4H3/t9-,11+,14-,15+/m0/s1
InChIKeyNWZKOCPFFSDCBI-OCVOHJKQSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies G1-a14 (ncbitaxon:1604234) - PubMed (25603174)
ChEBI Ontology
Outgoing Relation(s)
(3R,6R)-dihydroxy-9,7(11)-dien-8-oxoeremophilane (CHEBI:204558) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4R,4aR,5R,6R)-4,6-dihydroxy-4a,5-dimethyl-3-propan-2-ylidene-5,6,7,8-tetrahydro-4H-naphthalen-2-one
Manual XrefsDatabases
78437158ChemSpider