Compound Identification
SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(OCC3=CC=CC=C3)=C4)[C@@H]1C[C@H](CBr)N1OC(=O)N([C@@H]21)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=BAMBCLXZRAIFOV-NZMGSFEPSA-N
Formula
C33H34BrClN2O3
Mass
622.0
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
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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
Phenanthrenes and derivatives Tetralins Phenol ethers Alkyl aryl ethers Chlorobenzenes Piperidines Aryl chlorides Oxadiazolidines Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organobromides Organochlorides Alkyl bromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
16-oxosteroid - Phenanthrene - Tetralin - Phenol ether - Halobenzene - Alkyl aryl ether - Chlorobenzene - Monocyclic benzene moiety - Benzenoid - Piperidine - Aryl chloride - Aryl halide - 1,2,4-oxadiazolidine - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Organic nitrogen compound - Organobromide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl bromide - Aromatic heteropolycyclic 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