Compound Identification
SMILES
[Na+].[Na+].C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3C(=O)C[C@]2(C)[C@@]1(OP([O-])([O-])=O)C(=O)CO
InChIKey
InChIKey=LMJNGHSDWDSJLL-GVDLCTMXSA-L
Formula
C22H27Na2O8P
Mass
496.403
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
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Subclass
Hydroxysteroids
- Level 5 21-hydroxysteroids
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Subclass
Hydroxysteroids
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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
Hydroxysteroids
Intermediate Tree Nodes
Not available
Direct Parent
21-hydroxysteroids
Alternative Parents
Gluco/mineralocorticoids, progestogins and derivatives 20-oxosteroids 3-oxo delta-1,4-steroids 11-oxosteroids Delta-1,4-steroids Glycerone phosphates Alkyl phosphates Alpha-hydroxy ketones Cyclic ketones Primary alcohols Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Progestogin-skeleton - 21-hydroxysteroid - 20-oxosteroid - Pregnane-skeleton - 3-oxo-delta-1,4-steroid - 3-oxosteroid - 11-oxosteroid - Oxosteroid - Delta-1,4-steroid - Glycerone phosphate - Organic phosphoric acid derivative - Phosphoric acid ester - Alkyl phosphate - Alpha-hydroxy ketone - Ketone - Cyclic ketone - Organic alkali metal salt - Alcohol - Hydrocarbon derivative - Organooxygen compound - Organic sodium salt - Organic oxide - Organic oxygen compound - Carbonyl group - Organic salt - Primary alcohol - Organic cation - Aliphatic homopolycyclic 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