CHEBI:65004 - (−)-secoisolariciresinol

Main ChEBI Ontology Automatic Xrefs
ChEBI Name (−)-secoisolariciresinol
ChEBI ID CHEBI:65004
ChEBI ASCII Name (-)-secoisolariciresinol
Definition An enantiomer of secoisolariciresinol having (−)-(2R,3R)-configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C20H26O6
Net Charge 0
Average Mass 362.41680
InChI InChI=1S/C20H26O6/c1-25-19-9-13(3-5-17(19)23)7-15(11-21)16(12-22)8-14-4-6-18(24)20(10-14)26-2/h3-6,9-10,15-16,21-24H,7-8,11-12H2,1-2H3/t15-,16-/m0/s1
InChIKey PUETUDUXMCLALY-HOTGVXAUSA-N
SMILES COc1cc(C[C@@H](CO)[C@H](CO)Cc2ccc(O)c(OC)c2)ccc1O
Metabolite of Species Details
Rubia yunnanensis (IPNI:765385-1) Found in root (BTO:0001188). Methanolic extract of air dried powdered roots. See: PubMed
Taxus yunnanensis (NCBI:147275) Found in xylem (BTO:0001468). Previous component: wood; Aqueous extract of air-dried, powdered wood See: PubMed
Roles Classification
Biological Role(s): 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(s): antidepressant
Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (−)-secoisolariciresinol (CHEBI:65004) has role antidepressant (CHEBI:35469)
(−)-secoisolariciresinol (CHEBI:65004) has role phytoestrogen (CHEBI:76989)
(−)-secoisolariciresinol (CHEBI:65004) has role plant metabolite (CHEBI:76924)
(−)-secoisolariciresinol (CHEBI:65004) is a secoisolariciresinol (CHEBI:67250)
(−)-secoisolariciresinol (CHEBI:65004) is enantiomer of (+)-secoisolariciresinol (CHEBI:67247)
Incoming (+)-secoisolariciresinol (CHEBI:67247) is enantiomer of (−)-secoisolariciresinol (CHEBI:65004)
IUPAC Name
(2R,3R)-2,3-bis(4-hydroxy-3-methoxybenzyl)butane-1,4-diol
Synonyms Sources
(−)-secoisolariciresinol UniProt
(-)-Secoisolariciresinol KEGG COMPOUND
Secoisolariciresinol KEGG COMPOUND
Database Links Databases
C18167 KEGG COMPOUND
CPD-8909 MetaCyc
HMDB13692 HMDB
View more database links
Registry Numbers Types Sources
1893026 Reaxys Registry Number Reaxys
29388-59-8 CAS Registry Number KEGG COMPOUND
29388-59-8 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
15653677 PubMed citation SUBMITTER
21837520 PubMed citation CiteXplore
21897049 PubMed citation CiteXplore
21958542 PubMed citation CiteXplore
22030618 PubMed citation CiteXplore
22037685 PubMed citation CiteXplore
22476613 PubMed citation CiteXplore
Last Modified
28 July 2014