Structure Information
Structure

Compound Identification

SMILES

COC1=C2OC3=C(C=C(CCC(=O)CCCCC(C=C1)=C2)C=C3)[N+]([O-])=O

InChIKey

InChIKey=VXCITUKBJQIMKS-UHFFFAOYSA-N

Formula

C20H21NO5

Mass

355.39

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Subclass

Cyclic diarylheptanoids

Intermediate Tree Nodes

Not available

Direct Parent

Meta,para-diphenylether diarylheptanoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Meta,para-diphenylether diarylheptanoid - Oxyneolignan skeleton - Diaryl ether - Nitroaromatic compound - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Ketone - C-nitro compound - Organic nitro compound - Cyclic ketone - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Ether - Oxacycle - Organic oxoazanium - Organic salt - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as meta,para-diphenylether diarylheptanoids. These are cyclic diarylheptanoids where the two benzene rings are linked to each other by an ether group conjugated to the 3-position of one benzene ring and the 4-position of the other ring.

External Descriptors

Not available

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