Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(\C=C\C(=O)C2CC(CCC2=O)[N+]([O-])=O)C=C1.COC1=CC=C(\C=C\C(=O)C2C(C(C(CC2=O)C2=CC=C(OC)C=C2)[N+]([O-])=O)C2=CC(=CC=C2)[N+]([O-])=O)C=C1

InChIKey

InChIKey=YIUDKBHLOCWTOU-OGTQOGBDSA-N

Formula

C45H43N3O13

Mass

833.847

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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

Not available

Substituents

Linear 1,7-diphenylheptane skeleton - Cinnamic acid or derivatives - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Anisole - Methoxybenzene - Phenol ether - Styrene - Alkyl aryl ether - 1,3-diketone - Monocyclic benzene moiety - 1,3-dicarbonyl compound - Benzenoid - Alpha,beta-unsaturated ketone - Acryloyl-group - Enone - Cyclic ketone - Organic nitro compound - C-nitro compound - Ketone - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Ether - Organic oxoazanium - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Organic salt - Organic nitrogen compound - Organic zwitterion - Aromatic homomonocyclic 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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