Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H](CC1=CC=CC=C1)OC1=CC=C(C=C1)C1=CC=C(C=C1)C1=C(CC2=CC=CC=C2)SC2=CC=CC=C12

InChIKey

InChIKey=ZULVFKGXAGFKDC-MGBGTMOVSA-N

Formula

C37H30O3S

Mass

554.7

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Subclass

Linear diarylheptanoids

Intermediate Tree Nodes

Not available

Direct Parent

Linear diarylheptanoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Linear 1,7-diphenylheptane skeleton - Biphenyl - Phenoxyacetate - Benzothiophene - 1-benzothiophene - Phenoxy compound - Phenol ether - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Heteroaromatic compound - Thiophene - Methyl ester - Carboxylic acid ester - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.

External Descriptors

Not available

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