Structure Information
Structure

Compound Identification

SMILES

CC(=O)OC1CC2(O)C(CCC3(C)C(CCC23O)C2=COC(=O)C=C2)C2(C)CCC(O)C=C12

InChIKey

InChIKey=SOJXCEWHLPYBAF-UHFFFAOYSA-N

Formula

C26H34O7

Mass

458.551

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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 - Steroid ester - 3-hydroxy-delta-4-steroid - 3-hydroxysteroid - 14-hydroxysteroid - Hydroxysteroid - Delta-4-steroid - Pyranone - Pyran - Heteroaromatic compound - Cyclic alcohol - Tertiary alcohol - Carboxylic acid ester - Secondary alcohol - Lactone - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Polyol - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organic oxide - Alcohol - Organooxygen compound - Hydrocarbon derivative - 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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