Structure Information
Structure

Compound Identification

SMILES

Cl.OC1=CC2=C(C=C1)[C@H]([C@H](CO2)C1=CC=CC=C1)C1=CC=C(SCCN2CCCC2)C=C1

InChIKey

InChIKey=UGVFICAXGMBKCH-MKOQQXGASA-N

Formula

C27H30ClNO2S

Mass

468.05

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

Hydroxyisoflavonoids

Intermediate Tree Nodes

Not available

Direct Parent

Hydroxyisoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Hydroxyisoflavonoid - Neoflavonoid skeleton - Neoflavan - Isoflavan - Stilbene - Chromane - Benzopyran - 1-benzopyran - Thiophenol ether - Aryl thioether - Alkyl aryl ether - Alkylarylthioether - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - N-alkylpyrrolidine - Monocyclic benzene moiety - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Ether - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Hydrochloride - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hydroxyisoflavonoids. These are organic compounds containing an isoflavonoid skeleton carrying one or more hydroxyl groups.

External Descriptors

Not available

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