Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=CC=C(N[C@H]2[C@H]3COC(=O)[C@@H]3[C@H](C3=CC(OC)=C(O)C(OC)=C3)C3=CC(OC)=C(OC)C=C23)C=C1

InChIKey

InChIKey=BWOFWMGBPOUISW-GVQBMFDGSA-N

Formula

C31H33NO9

Mass

563.603

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lignans, neolignans and related compounds

Class

Lignan lactones

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Lignan lactones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Lignan lactone - Tametraline - 1-aryltetralin lignan - Naphthofuran - Aminobenzoic acid or derivatives - Benzoate ester - Methoxyphenol - M-dimethoxybenzene - Dimethoxybenzene - Tetralin - Benzoic acid or derivatives - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Methoxybenzene - Phenylalkylamine - Aniline or substituted anilines - Aralkylamine - Secondary aliphatic/aromatic amine - Phenol - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Gamma butyrolactone - Tetrahydrofuran - Lactone - Carboxylic acid ester - Amino acid or derivatives - Secondary amine - Organoheterocyclic compound - Ether - Oxacycle - Carboxylic acid derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as lignan lactones. These are lignans that contain a lactone moiety. They include 1-aryltetralin lactones, dibenzylbutyrolactone lignans, and podophyllotoxins, among others.

External Descriptors

Not available

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