Structure Information
Structure

Compound Identification

SMILES

OC1=CC(O)=C(C=C1)C1COC2=C(C=CC(O)=C2)C1=O

InChIKey

InChIKey=WBOWBLGZAXVREM-UHFFFAOYSA-N

Formula

C15H12O5

Mass

272.256

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

Isoflavans

Intermediate Tree Nodes

Not available

Direct Parent

Isoflavanones

Alternative Parents

Isoflavanols Hydroxyisoflavonoids Chromones Resorcinols Aryl alkyl ketones Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Oxacyclic compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoflavanone - Isoflavanol - Hydroxyisoflavonoid - Chromone - 1-benzopyran - Chromane - Benzopyran - Resorcinol - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Monocyclic benzene moiety - Ketone - Oxacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoflavanones. These are polycyclic compounds containing an isoflavan skeleton which bears a ketone at position C4.

External Descriptors

CHEBI:16035 : hydroxyisoflavanone
LIPIDMAPS (LMPK12050463) : Isoflavonoids
KEGG (C03567) : isoflavanones - Isoflavonoids
META CYC (2-HYDROXY-23-DIHYDRODAIDZEIN) : a small molecule

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