Structure Information
Structure

Compound Identification

SMILES

COC1=CC(C=O)=CC2=C1OC1C2C(=CC(C1O)N(CC1CC1)C(=O)C1=CC2=CC=CC=C2OC1=O)C(=O)NCCO

InChIKey

InChIKey=LVZFCPVDJCDGGB-UHFFFAOYSA-N

Formula

C31H30N2O9

Mass

574.586

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Coumarins and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Coumarin - Benzopyran - 1-benzopyran - Coumaran - Anisole - N-acylethanolamine - Phenol ether - Alkyl aryl ether - Aryl-aldehyde - Pyranone - Benzenoid - Pyran - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Lactone - Secondary carboxylic acid amide - Secondary alcohol - Oxacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Alkanolamine - Organooxygen compound - Organonitrogen compound - Aldehyde - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Organic oxygen compound - Primary alcohol - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).

External Descriptors

Not available

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