Structure Information
Structure

Compound Identification

SMILES

CCCCB1OC2=C(O1)C=C(C(=O)C(C)C1=CC=C(O)C=C1)C(OC)=C2

InChIKey

InChIKey=ZNCATWRVXWVYAG-UHFFFAOYSA-N

Formula

C20H23BO5

Mass

354.21

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Alpha-methyldeoxybenzoin flavonoids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Alpha-methyldeoxybenzoin flavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-methyldeoxybenzoin flavonoid - Stilbene - Anisole - Phenol ether - Aryl alkyl ketone - Aryl ketone - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Boronic acid ester - Ketone - Boronic acid derivative - Organic metalloid salt - Oxacycle - Ether - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organic metalloid moeity - Organic oxygen compound - Organic oxide - Alkylborane - Monoalkylborane - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alpha-methyldeoxybenzoin flavonoids. These are flavonoids with a structure based on a 1,2-diphenyl-2-propan-2-one.

External Descriptors

Not available

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