CHEBI:8616 - psoralidin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name psoralidin
ChEBI ID CHEBI:8616
Definition A member of the class of coumestans that is coumestan substituted by hydroxy groups at positions 3 and 9 and a prenyl group at position 2 respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Wikipedia License
Waiting for wikipedia content
Read full article at Wikipedia
Formula C20H16O5
Net Charge 0
Average Mass 336.33800
Monoisotopic Mass 336.100
InChI InChI=1S/C20H16O5/c1-10(2)3-4-11-7-14-17(9-15(11)22)25-20(23)18-13-6-5-12(21)8-16(13)24-19(14)18/h3,5-9,21-22H,4H2,1-2H3
InChIKey YABIJLLNNFURIJ-UHFFFAOYSA-N
SMILES CC(C)=CCc1cc2c3oc4cc(O)ccc4c3c(=O)oc2cc1O
Metabolite of Species Details
Cullen corylifolium (NCBI:txid429560) 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.
estrogen receptor agonist
An agonist at the estrogen receptor.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing psoralidin (CHEBI:8616) has functional parent coumestan (CHEBI:72578)
psoralidin (CHEBI:8616) has role estrogen receptor agonist (CHEBI:63951)
psoralidin (CHEBI:8616) has role plant metabolite (CHEBI:76924)
psoralidin (CHEBI:8616) is a δ-lactone (CHEBI:18946)
psoralidin (CHEBI:8616) is a coumestans (CHEBI:72577)
psoralidin (CHEBI:8616) is a polyphenol (CHEBI:26195)
IUPAC Name
3,9-dihydroxy-2-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c][1]benzopyran-6-one
Synonym Source
3,9-Dihydroxy-2-prenylcoumestan LIPID MAPS
Manual Xrefs Databases
C00002566 KNApSAcK
C10523 KEGG COMPOUND
HMDB0034050 HMDB
LMPK12090007 LIPID MAPS
Psoralidin Wikipedia
View more database links
Registry Numbers Types Sources
18642-23-4 CAS Registry Number ChemIDplus
320069 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
24507928 PubMed citation Europe PMC
25216634 PubMed citation Europe PMC
Last Modified
12 June 2015