Structure Information
Structure

Compound Identification

SMILES

CC1CC(OC(C)=O)C(O)C(OC2CCC3(C(O)CC(O)=O)C4C(O)C(=O)C5(C)C(CCC5(O)C4CCC3(O)C2)C2=COC(=O)C=C2)O1

InChIKey

InChIKey=GLVLEJHYDJORRZ-UHFFFAOYSA-N

Formula

C34H46O14

Mass

678.728

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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

Not available

Direct Parent

Bufanolides and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Bufanolide-skeleton - Steroidal glycoside - 19-hydroxysteroid - Hydroxysteroid - 5-hydroxysteroid - 14-hydroxysteroid - 11-hydroxysteroid - 12-oxosteroid - Oxosteroid - Carbocyclic fatty acid - Beta-hydroxy acid - Hydroxy fatty acid - Pyranone - Fatty acyl - Dicarboxylic acid or derivatives - Oxane - Pyran - Hydroxy acid - Tertiary alcohol - Cyclic alcohol - Heteroaromatic compound - Carboxylic acid ester - Secondary alcohol - Lactone - Ketone - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Acetal - Carboxylic acid derivative - Polyol - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as bufanolides and derivatives. These are steroid lactones containing a pyran-2-one moiety linked to the C17 atom of a cyclopenta[a]phenanthrene derivative.

External Descriptors

Not available

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