Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)C1=C2OC(=O)C(C2=CC(CCC(O)=O)=C1)C1=CC=CC=C1

InChIKey

InChIKey=PFZIYTABXKFRKI-UHFFFAOYSA-N

Formula

C21H22O4

Mass

338.403

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Coumarans

Subclass

1-phenylcoumarans

Intermediate Tree Nodes

Not available

Direct Parent

1-phenylcoumarans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenylcoumaran - Benzofuran - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-phenylcoumarans. These are compounds containing a coumaran ring system substituted at the 1-position with phenyl group.

External Descriptors

Not available

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