Structure Information
Structure

Compound Identification

SMILES

CC1OC(O[C@H]2CCC3(C)[C@H]4CCC5(C)[C@H](CCC5(O)C4CCC3=C2)C2=COC(=O)C=C2)C(O)C(O)C1O

InChIKey

InChIKey=MYEJFUXQJGHEQK-OLTNDVDHSA-N

Formula

C30H42O8

Mass

530.658

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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 - 14-hydroxysteroid - Hydroxysteroid - Delta-4-steroid - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Pyranone - Pyran - Oxane - Monosaccharide - Tertiary alcohol - Cyclic alcohol - Heteroaromatic compound - Secondary alcohol - Lactone - Polyol - Organoheterocyclic compound - Acetal - Oxacycle - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Alcohol - 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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