Structure Information
Structure

Compound Identification

SMILES

COC1=C(O)C(OCC2NC(C)CC3(CCCC3)C22C(C=CC2C2=CCNC(N)=C2)C(O)=O)=CC(=C1)C1OC(CCC2=CC=C(O)C(OCNC34C=CC5CCC(C=C3)C5C4O)=C2)CC(O)C1CCO

InChIKey

InChIKey=GRLXYERODPVQLA-UHFFFAOYSA-N

Formula

C55H72N4O11

Mass

965.198

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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 - Methoxyphenol - Azaspirodecane - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Hydroxy fatty acid - Heterocyclic fatty acid - Dihydropyridine - Branched fatty acid - Alkyl aryl ether - Fatty acyl - Benzenoid - Piperidine - Oxane - Hydropyridine - Monocyclic benzene moiety - Amino acid - Secondary alcohol - Amino acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Ether - Secondary aliphatic amine - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Alcohol - 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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