Structure Information
Structure

Compound Identification

SMILES

COC1=CC(O)=C(C2C3=CCC4C(C3CC3C(=O)C(=CC(=O)C23C2=CC=CC=C2)C2=CC=CC=C2)C(=O)N(C4=O)C2=CC=C(C=C2)C2=NC3=CC=CC=C3O2)C(OC)=C1

InChIKey

InChIKey=SHSAFAVEBXHIMN-UHFFFAOYSA-N

Formula

C49H38N2O8

Mass

782.849

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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 - Anthraquinone - 1,4-anthraquinone - Stilbene - Cyclohexylphenol - 1-phenylpyrrolidine - Phenyl-1,3-oxazole - Methoxyphenol - Isoindolone - Dimethoxybenzene - M-dimethoxybenzene - Isoindole or derivatives - Isoindole - Isoindoline - Benzoxazole - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Cyclohexenone - 1-hydroxy-4-unsubstituted benzenoid - Benzenoid - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Carboxylic acid imide - Dicarboximide - Pyrrolidine - Pyrrole - Oxazole - Ketone - Lactam - Organoheterocyclic compound - Ether - Azacycle - Carboxylic acid derivative - Oxacycle - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen 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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