EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:66432 - schisanwilsonene A

ChEBI IDCHEBI:66432
ChEBI Nameschisanwilsonene A
Stars
DefinitionA sesquiterpenoid isolated from Schisandra wilsoniana and has been shown to exhibit anti-HBV activity.
Last Modified26 April 2013
DownloadsMolfile
FormulaC15H26O2
Net Charge0
Average Mass238.371
Monoisotopic Mass238.19328
SMILES[H][C@]12CC=C(CO)CC[C@]1(C)CC[C@H]2C(C)(C)O
InChIInChI=1S/C15H26O2/c1-14(2,17)12-7-9-15(3)8-6-11(10-16)4-5-13(12)15/h4,12-13,16-17H,5-10H2,1-3H3/t12-,13-,15-/m1/s1
InChIKeyQNYUIPNTIJJURA-UMVBOHGHSA-N
Species of MetaboliteComponentSourceComments
Schisandra wilsoniana (IPNI:555083-1) fruit (BTO:0000486) PubMed (19228000)
Roles Classification
Biological Roles:
anti-HBV agent  An antiviral agent that destroys or inhibits the replication of the hepatitis B virus.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
schisanwilsonene A (CHEBI:66432) has role anti-HBV agent (CHEBI:64951)
schisanwilsonene A (CHEBI:66432) has role metabolite (CHEBI:25212)
schisanwilsonene A (CHEBI:66432) is a diol (CHEBI:23824)
schisanwilsonene A (CHEBI:66432) is a primary alcohol (CHEBI:15734)
schisanwilsonene A (CHEBI:66432) is a sesquiterpenoid (CHEBI:26658)
schisanwilsonene A (CHEBI:66432) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
2-[(1R,3aS,8aR)-6-(hydroxymethyl)-3a-methyl-1,2,3,3a,4,5,8,8a-octahydroazulen-1-yl]propan-2-ol
Registry NumbersSources
Reaxys:19717048Reaxys
Citations