Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC(OC)=C1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](SC(=O)[C@H](CC2=CC=C(O)C=C2)NC(=O)OCC2=CC=CC=C2)C2=CC3=C(OCO3)C=C12

InChIKey

InChIKey=DBXHSDQQCHUHIE-RSXGCLESSA-N

Formula

C38H35NO11S

Mass

713.75

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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 - 1-aryltetralin lignan - Tyrosine or derivatives - Phenylalanine or derivatives - Linear furanonaphthodioxole - Naphthofuran - Tetralin - Alpha-amino acid or derivatives - Dimethoxybenzene - M-dimethoxybenzene - Methoxyphenol - Benzyloxycarbonyl - Amphetamine or derivatives - Benzodioxole - Phenol ether - Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Gamma butyrolactone - Benzenoid - Oxolane - Carbamic acid ester - Carbothioic s-ester - Carboxylic acid ester - Thiocarboxylic acid ester - Lactone - Sulfenyl compound - Thiocarboxylic acid or derivatives - Acetal - Carboxylic acid derivative - Ether - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organosulfur compound - 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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