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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Vitamin D and derivatives
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Class
Steroids and steroid derivatives
-
Superclass
Lipids and lipid-like molecules
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
Triterpenoids Gluco/mineralocorticoids, progestogins and derivatives Steroid esters 20-oxosteroids Halogenated steroids 3-oxo-5-beta-steroids 17-hydroxysteroids Acyloins Tertiary alcohols Alpha-hydroxy ketones Alpha-chloroketones Cyclic ketones Cyclic alcohols and derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
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