Structure Information
Structure

Compound Identification

SMILES

CC1CC2(SCC=N2)C2(O)OC3CC4(C)C(CC5OC55C4C(O)C(=O)C4(C)C(CCC54O)C4(N)COC(=O)C4)CC3OC2O1

InChIKey

InChIKey=BITSJUPVLHTCDN-UHFFFAOYSA-N

Formula

C31H42N2O10S

Mass

634.74

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Steroid lactones

Intermediate Tree Nodes

Cardenolides and derivatives

Direct Parent

Cardenolide glycosides and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cardanolide-glycoside - Oxepane - Para-dioxane - Gamma butyrolactone - Oxane - Cyclic alcohol - Meta-thiazoline - Tetrahydrofuran - Tertiary alcohol - Amino acid or derivatives - Carboxylic acid ester - Hemiacetal - Ketone - Lactone - Secondary alcohol - Acetal - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkylthioether - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Polyol - Thioether - Organic oxygen compound - Carbonyl group - Imine - Organic nitrogen compound - Organopnictogen compound - Primary aliphatic amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Alcohol - Primary amine - Amine - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cardenolide glycosides and derivatives. These are compounds containing a carbohydrate glycosidically bound to the cardenolide moiety.

External Descriptors

Not available

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