CHEBI:9183 - sojagol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name sojagol
ChEBI ID CHEBI:9183
Definition A member of the class of coumestans that is coumestan substituted by a hydroxy group at position 3 and a 2,2-dimethylpyran group across positions 9 and 10.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C20H16O5
Net Charge 0
Average Mass 336.33800
Monoisotopic Mass 336.09977
InChI InChI=1S/C20H16O5/c1-20(2)8-7-12-14(25-20)6-5-13-16-18(24-17(12)13)11-4-3-10(21)9-15(11)23-19(16)22/h3-6,9,21H,7-8H2,1-2H3
InChIKey GSAVLDZAGYKJSO-UHFFFAOYSA-N
SMILES CC1(C)CCc2c(O1)ccc1c2oc2c1c(=O)oc1cc(O)ccc21
Metabolite of Species Details
Glycine max (NCBI:txid3847) 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing sojagol (CHEBI:9183) has functional parent coumestan (CHEBI:72578)
sojagol (CHEBI:9183) has role plant metabolite (CHEBI:76924)
sojagol (CHEBI:9183) is a δ-lactone (CHEBI:18946)
sojagol (CHEBI:9183) is a coumestans (CHEBI:72577)
sojagol (CHEBI:9183) is a phenols (CHEBI:33853)
IUPAC Name
10-hydroxy-3,3-dimethyl-2,3-dihydro-1H,7H-pyrano[2',3':6,7][1]benzofuro[3,2-c][1]benzopyran-7-one
Manual Xrefs Databases
C00002572 KNApSAcK
C10529 KEGG COMPOUND
HMDB0034027 HMDB
LMPK12090012 LIPID MAPS
View more database links
Registry Numbers Types Sources
1628647 Reaxys Registry Number Reaxys
18979-00-5 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
16659156 PubMed citation Europe PMC
IND92021101 Agricola citation Europe PMC
Last Modified
12 June 2015