Structure Information
Structure

Compound Identification

SMILES

C[C@]12CCC(=O)C=C1CC[C@H]1[C@@H]3CC[C@]4(OC[C@]34CC[C@H]21)C(=O)CO

InChIKey

InChIKey=SQJFHKGMUFRZBA-OHXCOFTBSA-N

Formula

C21H28O4

Mass

344.451

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Hydroxysteroids

Intermediate Tree Nodes

Not available

Direct Parent

21-hydroxysteroids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

21-hydroxysteroid - 20-oxosteroid - Oxosteroid - 3-oxosteroid - Cyclohexenone - Oxepane - Alpha-hydroxy ketone - Cyclic ketone - Oxetane - Ketone - Oxacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 21-hydroxysteroids. These are steroids carrying a hydroxyl group at the 21-position of the steroid backbone.

External Descriptors

Not available

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