Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(=CC1=CC2=CC=CC=C2OC1C1=CC=CC=C1)C#N

InChIKey

InChIKey=SECSIGLDGGUHEA-UHFFFAOYSA-N

Formula

C21H17NO3

Mass

331.371

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

Flav-3-enes

Intermediate Tree Nodes

Not available

Direct Parent

3-prenylated flav-3-enes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-prenylated flav-3-ene - Benzopyran - 1-benzopyran - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Organopnictogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Cyanide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3-prenylated flav-3-enes. These are flav3-enes that features a C5-isoprenoid substituent at the 3-position.

External Descriptors

Not available

Previous Back Next