Structure Information
Structure

Compound Identification

SMILES

OC1=CC2=C(C=C1)[C@@H]([C@H](CO2)C1=CC=C(F)C=C1)C1=CC=C(OCCN2CCCC2)C=C1

InChIKey

InChIKey=ODECIUXODNSCIA-VPUSJEBWSA-N

Formula

C27H28FNO3

Mass

433.523

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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

Neoflavans Isoflavans Stilbenes 1-benzopyrans Phenoxy compounds Phenol ethers 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Fluorobenzenes N-alkylpyrrolidines Aryl fluorides Trialkylamines Oxacyclic compounds Azacyclic compounds Organofluorides Hydrocarbon derivatives Organopnictogen compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Hydroxyisoflavonoid - Isoflavan - Neoflavan - Neoflavonoid skeleton - Stilbene - Chromane - Benzopyran - 1-benzopyran - Phenoxy compound - Phenol ether - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Fluorobenzene - Halobenzene - Phenol - Aryl halide - Benzenoid - N-alkylpyrrolidine - Monocyclic benzene moiety - Aryl fluoride - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Azacycle - Oxacycle - Organoheterocyclic compound - Ether - Organooxygen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen 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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