Structure Information
Structure

Compound Identification

SMILES

CC1=C(C)C(C(=O)C2=CC(C)=C(OS(=O)(=O)C3=C(O)C=C(C=C3)C(O)=O)C(=C2)C2=CC=CC=C2)=C(CC2=CC=CC=C2)O1

InChIKey

InChIKey=BPCZZGUMONTTJP-UHFFFAOYSA-N

Formula

C34H28O8S

Mass

596.65

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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 heteromonocyclic compounds

Substituents

Linear 1,7-diphenylheptane skeleton - Aryl-phenylketone - Biphenyl - Benzenesulfonate ester - Hydroxybenzoic acid - Benzenesulfonate - Benzenesulfonyl group - Benzoic acid or derivatives - Benzoic acid - Arylsulfonic acid or derivatives - Benzoyl - Aryl ketone - 3-aroylfuran - Phenoxy compound - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Toluene - Phenol - Benzenoid - Organosulfonic acid ester - Monocyclic benzene moiety - Heteroaromatic compound - Furan - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketone - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic 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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