EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:181290 - [(6S,9aS)-6,9a-dimethyl-1,3,4,5,5a,7,8,9-octahydrobenzo[e][2]benzofuran-6-yl]methanol

ChEBI IDCHEBI:181290
ChEBI Name[(6S,9aS)-6,9a-dimethyl-1,3,4,5,5a,7,8,9-octahydrobenzo[e][2]benzofuran-6-yl]methanol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O2
Net Charge0
Average Mass236.355
Monoisotopic Mass236.17763
SMILESC[C@]1(CO)CCC[C@]2(C)C3=C(CCC12)COC3
InChIInChI=1S/C15H24O2/c1-14(10-16)6-3-7-15(2)12-9-17-8-11(12)4-5-13(14)15/h13,16H,3-10H2,1-2H3/t13?,14-,15-/m1/s1
InChIKeyWNLDVGWQXMRYIC-JVIGXAJISA-N
ChEBI Ontology
Outgoing Relation(s)
[(6S,9aS)-6,9a-dimethyl-1,3,4,5,5a,7,8,9-octahydrobenzo[e][2]benzofuran-6-yl]methanol (CHEBI:181290) is a naphthofuran (CHEBI:39270)
IUPAC Name 
[(6S,9aS)-6,9a-dimethyl-1,3,4,5,5a,7,8,9-octahydrobenzo[e][2]benzouran-6-yl]methanol
Manual XrefsDatabases
76855265ChemSpider