Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=CLHOQFOFZHJBHD-NLCGFYSRSA-N

Formula

C23H33ClO5

Mass

424.96

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Steroids and steroid derivatives

Subclass

Vitamin D and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Vitamin D and derivatives

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Polycyclic triterpenoid - Triterpenoid - Progestogin-skeleton - Pregnane-skeleton - Steroid ester - 20-oxosteroid - 3-oxo-5-beta-steroid - 17-hydroxysteroid - Oxosteroid - Hydroxysteroid - Halo-steroid - 4-halo-steroid - 3-oxosteroid - Acyloin - Alpha-haloketone - Alpha-chloroketone - Tertiary alcohol - Cyclic alcohol - Alpha-hydroxy ketone - Cyclic ketone - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Alcohol - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as vitamin d and derivatives. These are compounds containing a secosteroid backbone, usually secoergostane or secocholestane.

External Descriptors

Not available

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