Structure Information
Structure

Compound Identification

SMILES

CN(C)S(=O)(=O)OC1=CC2=C(C=C1)C(C(CO2)C1=CC=C(C)C=C1)C1=CC=C(OCCN2CCCC2)C=C1

InChIKey

InChIKey=FBMMPRGHYKPJEH-UHFFFAOYSA-N

Formula

C30H36N2O5S

Mass

536.69

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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

Isoflavans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoflavan - Neoflavan - Neoflavonoid skeleton - Stilbene - Chromane - Benzopyran - 1-benzopyran - Phenoxy compound - Phenol ether - Toluene - Alkyl aryl ether - N-alkylpyrrolidine - Benzenoid - Monocyclic benzene moiety - Organic sulfuric acid or derivatives - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Ether - Oxacycle - Azacycle - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoflavans. These are polycyclic compounds with a structure based on the 3-phenyl-3,4-dihydro-2H-1-benzopyran skeleton.

External Descriptors

Not available

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