Structure Information
Structure

Compound Identification

SMILES

OC1CCCC(=O)C2=CC(OC3=CC=C(CC1)C=C3)=C(O)C=C2

InChIKey

InChIKey=CEXYRWKADWHPNI-UHFFFAOYSA-N

Formula

C19H20O4

Mass

312.365

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Subclass

Cyclic diarylheptanoids

Intermediate Tree Nodes

Not available

Direct Parent

Meta,para-diphenylether diarylheptanoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Meta,para-diphenylether diarylheptanoid - Oxyneolignan skeleton - Diaryl ether - Aryl alkyl ketone - Aryl ketone - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Benzenoid - Ketone - Secondary alcohol - Ether - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Alcohol - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as meta,para-diphenylether diarylheptanoids. These are cyclic diarylheptanoids where the two benzene rings are linked to each other by an ether group conjugated to the 3-position of one benzene ring and the 4-position of the other ring.

External Descriptors

Not available

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