Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H](C)NC(=O)COC1=CC(O)=C2C(=O)C(=COC2=C1)C1=CC2=C(OCCO2)C=C1

InChIKey

InChIKey=IKPNEDWDRDUMDS-GFCCVEGCSA-N

Formula

C23H21NO9

Mass

455.419

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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

Isoflavone - Hydroxyisoflavonoid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid ester - Chromone - Alanine or derivatives - 1-benzopyran - Benzopyran - Benzodioxane - Alpha-amino acid or derivatives - Benzo-1,4-dioxane - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - Pyran - Para-dioxin - Benzenoid - Heteroaromatic compound - Vinylogous acid - Methyl ester - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organopnictogen compound - Organooxygen 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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