Structure Information
Structure

Compound Identification

SMILES

COC1=C(C)C2=C(C[C@@H](O)[C@H](O2)C2=CC=C(O)C=C2)C=C1

InChIKey

InChIKey=PSCVPMJLJOIQKC-RHSMWYFYSA-N

Formula

C17H18O4

Mass

286.327

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

O-methylated flavonoids

Intermediate Tree Nodes

Not available

Direct Parent

7-O-methylated flavonoids

Alternative Parents

Flavan-3-ols 4'-hydroxyflavonoids 3-hydroxyflavonoids 1-benzopyrans Anisoles Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Secondary alcohols Oxacyclic compounds Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

7-methoxyflavonoid-skeleton - 3-hydroxyflavonoid - 4'-hydroxyflavonoid - Hydroxyflavonoid - Flavan-3-ol - Flavan - 1-benzopyran - Chromane - Benzopyran - Anisole - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Benzenoid - Monocyclic benzene moiety - Secondary alcohol - Organoheterocyclic compound - Oxacycle - Ether - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 7-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C7 atom of the flavonoid backbone.

External Descriptors

LIPIDMAPS (LMPK12020006) : Flavans, Flavanols and Leucoanthocyanidins

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