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CHEBI:40 - (+)-pinoresinol

ChEBI IDCHEBI:40
ChEBI Name(+)-pinoresinol
Stars
DefinitionAn enantiomer of pinoresinol having (+)-1S,3aR,4S,6aR-configuration.
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H22O6
Net Charge0
Average Mass358.390
Monoisotopic Mass358.14164
SMILES[H][C@]12CO[C@H](c3ccc(O)c(OC)c3)[C@@]1([H])CO[C@@H]2c1ccc(O)c(OC)c1
InChIInChI=1S/C20H22O6/c1-23-17-7-11(3-5-15(17)21)19-13-9-26-20(14(13)10-25-19)12-4-6-16(22)18(8-12)24-2/h3-8,13-14,19-22H,9-10H2,1-2H3/t13-,14-,19+,20+/m0/s1
InChIKeyHGXBRUKMWQGOIE-AFHBHXEDSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Rubia yunnanensis (IPNI:765385-1) root (BTO:0001188) PubMed (21973054) Methanolic extract of air dried powdered roots.
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
phytoestrogen  Any compound produced by a plant that happens to have estrogenic activity.
Application:
hypoglycemic agent  A drug which lowers the blood glucose level.
ChEBI Ontology
Outgoing Relation(s)
(+)-pinoresinol (CHEBI:40) has role hypoglycemic agent (CHEBI:35526)
(+)-pinoresinol (CHEBI:40) has role phytoestrogen (CHEBI:76989)
(+)-pinoresinol (CHEBI:40) has role plant metabolite (CHEBI:76924)
(+)-pinoresinol (CHEBI:40) is a pinoresinol (CHEBI:8225)
IUPAC Name 
(7α,7'α,8α,8'α)-3,3'-dimethoxy-7,9':7',9-diepoxylignane-4,4'-diol
Synonyms  Source
pinoresinolChemIDplus
4,4'-(1S,3aR,4S,6aR)-tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diylbis(2-methoxyphenol)IUPAC
UniProt Name  Source
(+)-pinoresinolUniProt
Manual XrefsDatabases
C05366KEGG COMPOUND
CPD-8905MetaCyc
PinoresinolWikipedia
C00007190KNApSAcK
Registry NumbersSources
Reaxys:4238046Reaxys
CAS:487-36-5ChemIDplus
CAS:487-36-5KEGG COMPOUND
Citations