Compound Identification
SMILES
COC(=O)CC1C2CCC3C(C)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C3(C)C2CC(Br)C1=O
InChIKey
InChIKey=LLNRCQIDTJPGFN-UHFFFAOYSA-N
Formula
C25H35BrO9
Mass
559.45
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 16-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
16-oxosteroids
Alternative Parents
Hydrophenanthrenes Tetracarboxylic acids and derivatives Cyclitols and derivatives Methyl esters Alpha-haloketones Cyclic ketones Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
16-oxosteroid - Hydrophenanthrene - Phenanthrene - Tetracarboxylic acid or derivatives - Cyclitol or derivatives - Alpha-haloketone - Methyl ester - Carboxylic acid ester - Cyclic ketone - Ketone - Carboxylic acid derivative - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Alkyl halide - Alkyl bromide - Organobromide - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 16-oxosteroids. These are steroid derivatives carrying a C=O group at the 16-position of the steroid skeleton.
External Descriptors
Not available