CHEBI:142880 - 7,2'-dihydroxy-4'-methoxyisoflavanol

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ChEBI Name 7,2'-dihydroxy-4'-methoxyisoflavanol
ChEBI ID CHEBI:142880
Definition A member of the class of isoflavans that is isoflavan-4-ol substituted at positions 7 and 2' by hydroxy groups and at position 4' by a methoxy group.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C16H16O5
Net Charge 0
Average Mass 288.299
Monoisotopic Mass 288.09977
InChI InChI=1S/C16H16O5/c1-20-10-3-5-11(14(18)7-10)13-8-21-15-6-9(17)2-4-12(15)16(13)19/h2-7,13,16-19H,8H2,1H3
InChIKey YZBBUYKPTHDZHF-UHFFFAOYSA-N
SMILES COC1=CC=C(C2COC3=CC(O)=CC=C3C2O)C(O)=C1
Metabolite of Species Details
Solanum lyratum (NCBI:txid230192) Found in whole plant (BTO:0001461). 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.
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ChEBI Ontology
Outgoing 7,2'-dihydroxy-4'-methoxyisoflavanol (CHEBI:142880) has role plant metabolite (CHEBI:76924)
7,2'-dihydroxy-4'-methoxyisoflavanol (CHEBI:142880) is a aromatic ether (CHEBI:35618)
7,2'-dihydroxy-4'-methoxyisoflavanol (CHEBI:142880) is a hydroxyisoflavans (CHEBI:76250)
7,2'-dihydroxy-4'-methoxyisoflavanol (CHEBI:142880) is a methoxyisoflavan (CHEBI:77002)
7,2'-dihydroxy-4'-methoxyisoflavanol (CHEBI:142880) is a secondary alcohol (CHEBI:35681)
Incoming (3R)-7,2'-dihydroxy-4'-methoxyisoflavanol (CHEBI:71335) is a 7,2'-dihydroxy-4'-methoxyisoflavanol (CHEBI:142880)
(3S,4R)-7,2'-dihydroxy-4'-methoxyisoflavanol (CHEBI:142866) is a 7,2'-dihydroxy-4'-methoxyisoflavanol (CHEBI:142880)
IUPAC Name
3-(2-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-chromene-4,7-diol
Synonyms Sources
3-(2-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4,7-diol IUPAC
4'-methoxyisoflavan-2',4,7-triol ChEBI
Citations Waiting for Citations Types Sources
20522996 PubMed citation Europe PMC
8071365 PubMed citation SUBMITTER
Last Modified
15 November 2021