Structure Information
Structure

Compound Identification

SMILES

CCCCCCC1=CC(C#CC2=CC(=CC(=C2)C#CC2=C(CCCCCC)C=C(C#CC3=CC=C(OC(=O)C4=CC(C)(C)N([O])C4(C)C)C=C3)C(CCCCCC)=C2)C#CC2=C(CCCCCC)C=C(C#CC3=CC=C(OC(=O)C4=CC(C)(C)N([O])C4(C)C)C=C3)C(CCCCCC)=C2)=C(CCCCCC)C=C1C#CC1=CC=C(OC(=O)C2=CC(C)(C)N([O])C2(C)C)C=C1

InChIKey

InChIKey=XWGNYMLJBZEDQU-UHFFFAOYSA-N

Formula

C117H138N3O9

Mass

1730.403

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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 - Phenol ester - Tricarboxylic acid or derivatives - Phenoxy compound - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Pyrroline - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - 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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