Structure Information
Structure

Compound Identification

SMILES

O=C1O[C@H]2[C@@H](O1)C1=C(OCC3=CC=CC=C3)C=C(OCC3=CC=CC=C3)C=C1O[C@@H]2C1=CC(OCC2=CC=CC=C2)=C(OCC2=CC=CC=C2)C=C1

InChIKey

InChIKey=SFMIKBNXKBCELK-WJZFVOHWSA-N

Formula

C44H36O8

Mass

692.764

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

Flavans

Intermediate Tree Nodes

Flavan-3-ols

Direct Parent

Catechins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Catechin - Leucoanthocyanidin-skeleton - Chromane - Benzopyran - 1-benzopyran - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Carbonic acid diester - Meta-dioxolane - Carbonic acid derivative - Organoheterocyclic compound - Oxacycle - Ether - Organic oxygen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as catechins. These are compounds containing a catechin moiety, which is a 3,4-dihydro-2-chromene-3,5.7-tiol.

External Descriptors

Not available

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