Structure Information
Structure

Compound Identification

SMILES

COC1=C(C(=O)C2=C(C(O)=O)C(O)=C(O)C=C2O1)C1=C(C=C2C(=O)C3=C(C(O)=O)C(O)=C(O)C=C3OC2=C1C(C)=O)C(C)=O

InChIKey

InChIKey=HYNJWQUNCFKEGY-UHFFFAOYSA-N

Formula

C29H18O15

Mass

606.448

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

Isoflav-2-enes

Intermediate Tree Nodes

Not available

Direct Parent

Isoflavones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Hydroxyisoflavonoid - Isoflavone - Xanthone - Dibenzopyran - Xanthene - 2-methoxychromone - Chromone - Coumarin - Benzopyran - Hydroxybenzoic acid - Salicylic acid or derivatives - 1-benzopyran - Acetophenone - Aryl ketone - Aryl alkyl ketone - Pyranone - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Benzenoid - Pyran - Vinylogous ester - Heteroaromatic compound - Vinylogous acid - Ketone - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon atom.

External Descriptors

Not available

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