Structure Information
Structure

Compound Identification

SMILES

CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)OC4=C5COC(=O)C5=CC(O)=C4C[C@H]23)C1(C)C

InChIKey

InChIKey=BOVRDZLKBBUXQQ-BOWIAGTOSA-N

Formula

C25H32O6

Mass

428.525

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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 - Dibenzopyran - Xanthene - Naphthopyran - Chromane - Isobenzofuranone - Benzopyran - Naphthalene - 1-benzopyran - Phthalide - Isocoumaran - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Benzenoid - Pyran - Dicarboxylic acid or derivatives - Lactone - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Hydrocarbon derivative - 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

CHEBI:67848 : hydroxyisoflavans

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