Structure Information
Structure

Compound Identification

SMILES

CC[C@H](C[C@@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C

InChIKey

InChIKey=LXRLKMAYPPIRJM-GACZPLPESA-N

Formula

C29H48O2

Mass

428.701

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Stigmastanes and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Stigmastanes and derivatives

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Stigmastane-skeleton - Triterpenoid - Hydroxy bile acid, alcohol, or derivatives - Monohydroxy bile acid, alcohol, or derivatives - Bile acid, alcohol, or derivatives - 22-hydroxysteroid - 3-oxo-delta-4-steroid - Hydroxysteroid - 3-oxosteroid - Oxosteroid - Delta-4-steroid - Cyclohexenone - Ketone - Cyclic ketone - Secondary alcohol - Alcohol - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organooxygen compound - Organic oxygen compound - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as stigmastanes and derivatives. These are sterol lipids with a structure based on the stigmastane skeleton, which consists of a cholestane moiety bearing an ethyl group at the carbon atom C24.

External Descriptors

CHEBI:65998 : 3-oxo steroid - 22-hydroxy steroid

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