Compound Identification
SMILES
C[C@]12CC(=O)C3=C([C@@H](O)CC4C(C)(C)C(=O)CC[C@]34C)[C@]1(C)C(=O)C[C@@H]2C(=C)CCC(O)=O
InChIKey
InChIKey=APMICFQMLNFXRZ-RUGOWIIJSA-N
Formula
C27H36O6
Mass
456.579
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Oxosteroids
- Level 5 11-oxosteroids
-
Subclass
Oxosteroids
-
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
11-oxosteroids
Alternative Parents
7-alpha-hydroxysteroids 3-oxosteroids 14-alpha-methylsteroids Hydroxy fatty acids Cyclohexenones Unsaturated fatty acids Secondary alcohols Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
3-oxosteroid - 14-alpha-methylsteroid - Hydroxysteroid - 11-oxosteroid - 7-alpha-hydroxysteroid - 7-hydroxysteroid - Hydroxy fatty acid - Cyclohexenone - Fatty acyl - Unsaturated fatty acid - Fatty acid - Secondary alcohol - Ketone - Cyclic ketone - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Alcohol - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 11-oxosteroids. These are steroid derivatives carrying a C=O group at the 11-position of the steroid skeleton.
External Descriptors
Not available