Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC(OC)=C1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](NC2=CC=C(NC(=O)C3=CC(=CN3C)[N+]([O-])=O)C=C2)C2=CC3=C(OCO3)C=C12

InChIKey

InChIKey=JKDAETVNFABJQD-GEYQZXRLSA-N

Formula

C33H30N4O10

Mass

642.621

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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 - Linear furanonaphthodioxole - Aromatic anilide - Naphthofuran - Methoxyphenol - Tetralin - Dimethoxybenzene - M-dimethoxybenzene - Benzodioxole - Anisole - 2-heteroaryl carboxamide - Phenol ether - Methoxybenzene - Pyrrole-2-carboxamide - Phenylalkylamine - Aniline or substituted anilines - Pyrrole-2-carboxylic acid or derivatives - Phenoxy compound - Nitroaromatic compound - Phenol - Aralkylamine - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Monocyclic benzene moiety - Gamma butyrolactone - N-methylpyrrole - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Pyrrole - Oxolane - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactone - C-nitro compound - Amino acid or derivatives - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Oxacycle - Secondary amine - Carboxylic acid derivative - Ether - Organoheterocyclic compound - Azacycle - Acetal - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic oxygen compound - Organopnictogen compound - Organic zwitterion - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Amine - Organic salt - Organonitrogen compound - Organooxygen 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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