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
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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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
20-oxosteroids 3-oxosteroids Oxepanes Cyclohexenones Alpha-hydroxy ketones Oxetanes Oxacyclic compounds Dialkyl ethers Primary alcohols Organic oxides Hydrocarbon derivatives
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