EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:205077 - Phomalairdenone D

ChEBI IDCHEBI:205077
ChEBI NamePhomalairdenone D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O2
Net Charge0
Average Mass234.339
Monoisotopic Mass234.16198
SMILESC[C@@H]1CC[C@H]2[C@@](C)(CO)C[C@]3(C)C(=O)C=C[C@]123
InChIInChI=1S/C15H22O2/c1-10-4-5-11-13(2,9-16)8-14(3)12(17)6-7-15(10,11)14/h6-7,10-11,16H,4-5,8-9H2,1-3H3/t10-,11+,13-,14-,15+/m1/s1
InChIKeyNJGZFBDZQNEJEN-BJBXXJATSA-N
Species of MetaboliteComponentSourceComments
Plenodomus lingam (ncbitaxon:5022) - PubMed (15755649)
ChEBI Ontology
Outgoing Relation(s)
Phomalairdenone D (CHEBI:205077) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1R,5S,7S,8R,11R)-7-(hydroxymethyl)-5,7,11-trimethyltricyclo[6.3.0.01,5]undec-2-en-4-one
Manual XrefsDatabases
78437235ChemSpider