Compound Identification
SMILES
OCC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12CO
InChIKey
InChIKey=TXNMTZQJFAFSJJ-PYCASWLRSA-N
Formula
C20H28O4
Mass
332.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
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Subclass
Oxosteroids
- Level 5 20-oxosteroids
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Subclass
Oxosteroids
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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
Oxosteroids
Intermediate Tree Nodes
Not available
Direct Parent
20-oxosteroids
Alternative Parents
Estrogens and derivatives 18-hydroxysteroids 3-oxo delta-4-steroids Delta-4-steroids Long-chain fatty alcohols Cyclohexenones Monosaccharides Enones Alpha-hydroxy ketones Acryloyl compounds Organic oxides Hydrocarbon derivatives Alcohols and polyols
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
20-oxosteroid - 18-hydroxysteroid - Estrogen-skeleton - Hydroxysteroid - Estrane-skeleton - 3-oxosteroid - 3-oxo-delta-4-steroid - Delta-4-steroid - Long chain fatty alcohol - Fatty alcohol - Cyclohexenone - Fatty acyl - Monosaccharide - Alpha,beta-unsaturated ketone - Enone - Alpha-hydroxy ketone - Acryloyl-group - Cyclic ketone - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 20-oxosteroids. These are steroid derivatives carrying a C=O group at the 20-position of the steroid skeleton.
External Descriptors
Not available