Structure Information
Structure

Compound Identification

SMILES

OC1=CC=C(C=C1)[C@H]1COC2=CC=CC=C2[C@@H]1NC(=O)C(C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=QOTCWRLMSFLHKL-NAKRPHOHSA-N

Formula

C29H25NO3

Mass

435.523

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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

Isoflavanols

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoflavanol - Diphenylmethane - Chromane - Benzopyran - 1-benzopyran - Phenylacetamide - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Benzenoid - Carboxamide group - Secondary carboxylic acid amide - Oxacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoflavanols. These are polycyclic compounds containing a hydroxylated isoflavan skeleton.

External Descriptors

Not available

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