Structure Information
Structure

Compound Identification

SMILES

COC1=C(C(OC2=C1C=C(O)C=C2)C1=CC=C(OC[C@H](C)N2CC[C@@H](C)C2)C=C1)C1=C(C)C=C(O)C=C1

InChIKey

InChIKey=VFNPWRQDUBXOOR-IBTYXWRBSA-N

Formula

C31H35NO5

Mass

501.623

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Isoflavonoids

Subclass

O-methylated isoflavonoids

Intermediate Tree Nodes

Not available

Direct Parent

4-O-methylated isoflavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-methoxyflavonoid-skeleton - 4-methoxyisoflavonoid-skeleton - Hydroxyflavonoid - Hydroxyisoflavonoid - 6-hydroxyflavonoid - Flav-3-ene - Isoflav-3-ene skeleton - Stilbene - 1-benzopyran - Benzopyran - Phenoxy compound - Phenol ether - M-cresol - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Toluene - Phenol - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 4-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C4 atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.

External Descriptors

Not available

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