Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C1CCC2=C(O)C=C(O)C=C2O1

InChIKey

InChIKey=TZKJYXVKIZDLJU-UHFFFAOYSA-N

Formula

C16H16O4

Mass

272.3

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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

4'-O-methylated flavonoids

Alternative Parents

7-hydroxyflavonoids 5-hydroxyflavonoids Flavans 1-benzopyrans Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Oxacyclic compounds Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4p-methoxyflavonoid-skeleton - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Hydroxyflavonoid - Flavan - 1-benzopyran - Chromane - Benzopyran - Phenoxy compound - Methoxybenzene - Anisole - Phenol ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Benzenoid - Monocyclic benzene moiety - Organoheterocyclic compound - Oxacycle - Ether - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 4'-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C4' atom of the flavonoid backbone.

External Descriptors

LIPIDMAPS (LMPK12020263) : Flavans, Flavanols and Leucoanthocyanidins

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