Compound Identification
SMILES
OC(=O)\C=C\C(O)=O.CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]12C
InChIKey
InChIKey=ISRMCIRJIJHHAQ-MHZQTNJPSA-N
Formula
C25H30O6
Mass
426.509
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
Androgens and derivatives 3-oxo delta-1,4-steroids Delta-1,4-steroids Unsaturated fatty acids Dicarboxylic acids and derivatives Cyclic ketones Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
20-oxosteroid - Androgen-skeleton - Androstane-skeleton - 3-oxo-delta-1,4-steroid - 3-oxosteroid - Delta-1,4-steroid - Fatty acyl - Fatty acid - Unsaturated fatty acid - Dicarboxylic acid or derivatives - Cyclic ketone - Ketone - Carboxylic acid - Carboxylic acid derivative - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - 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