Compound Identification
SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)C1=C[C@@H](O)[C@]2(O)C(=O)C(O)CC(O)=O
InChIKey
InChIKey=IJJCEDQEYMJOLL-SAWZVWQGSA-N
Formula
C23H30O7
Mass
418.486
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
16-alpha-hydroxysteroids 17-hydroxysteroids 3-oxosteroids Gamma-keto acids and derivatives Short-chain keto acids and derivatives Beta hydroxy acids and derivatives Cyclohexenones Acyloins Alpha-hydroxy ketones Tertiary alcohols 1,2-diols Secondary alcohols Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
20-oxosteroid - 3-oxosteroid - 17-hydroxysteroid - 16-hydroxysteroid - 16-alpha-hydroxysteroid - Hydroxysteroid - Gamma-keto acid - Cyclohexenone - Beta-hydroxy acid - Short-chain keto acid - Acyloin - Hydroxy acid - Keto acid - Alpha-hydroxy ketone - Tertiary alcohol - 1,2-diol - Cyclic ketone - Secondary alcohol - Ketone - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - 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