CHEBI:133347 - glyceollin IV

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ChEBI Name glyceollin IV
Definition A member of the class of pterocarpans carrying two hydroxy substituents at positions 6a and 9 as well as prenyl and methoxy substituents at positions 2 and 3 respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C21H22O5
Net Charge 0
Average Mass 354.397
Monoisotopic Mass 354.14672
InChI InChI=1S/C21H22O5/c1-12(2)4-5-13-8-15-18(10-17(13)24-3)25-11-21(23)16-7-6-14(22)9-19(16)26-20(15)21/h4,6-10,20,22-23H,5,11H2,1-3H3/t20-,21+/m0/s1
SMILES [C@@]12([C@](C3=C(OC1)C=C(C(=C3)CC=C(C)C)OC)(OC=4C2=CC=C(C4)O)[H])O
Metabolite of Species Details
Glycine max (NCBI:txid3847) Found in seed (BTO:0001226). See: PubMed
Glycine max (NCBI:txid3847) Found in seed (BTO:0001226). See: MetaboLights Study
Glycine max (NCBI:txid3847) Found in seed (BTO:0001226). See: MetaboLights Study
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 glyceollin IV (CHEBI:133347) has role plant metabolite (CHEBI:76924)
glyceollin IV (CHEBI:133347) is a aromatic ether (CHEBI:35618)
glyceollin IV (CHEBI:133347) is a phenols (CHEBI:33853)
glyceollin IV (CHEBI:133347) is a pterocarpans (CHEBI:26377)
Synonym Source
6a,9-Dihydroxy-3-methoxy-2-prenylpterocarpan LIPID MAPS
Manual Xrefs Databases
C00009690 KNApSAcK
WO2012006750 Patent
View more database links
Registry Number Type Source
69393-94-8 CAS Registry Number KNApSAcK
Citations Waiting for Citations Types Sources
19116342 PubMed citation Europe PMC
21561073 PubMed citation Europe PMC
25296697 PubMed citation Europe PMC
25369450 PubMed citation Europe PMC
Last Modified
24 February 2017