Structure Information
Structure

Compound Identification

SMILES

CC1OC(OC2CCC3(C=O)C4CCC5(C)C(CCC5(O)C4CCC3(C2)OC(C)=O)C2=COC(=O)CC2N)C(O)C(O)C1O

InChIKey

InChIKey=IPPQDEROBNVUQC-UHFFFAOYSA-N

Formula

C32H47NO11

Mass

621.724

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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

Bufanolides and derivatives

Direct Parent

Bufanolide glycosides and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Bufanolide-glycoside - Steroidal glycoside - Steroid ester - 19-oxosteroid - 14-hydroxysteroid - Hydroxysteroid - Oxosteroid - Glycosyl compound - O-glycosyl compound - Dihydropyranone - Dicarboxylic acid or derivatives - Monosaccharide - Oxane - Tertiary alcohol - Cyclic alcohol - Enol ester - Secondary alcohol - Amino acid or derivatives - Carboxylic acid ester - Lactone - Polyol - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Acetal - Aldehyde - Organopnictogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary aliphatic amine - Alcohol - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Amine - Primary amine - Organooxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as bufanolide glycosides and derivatives. These are bufanolides that are glycosidically linked to a glucose moiety.

External Descriptors

Not available

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