Compound Identification
SMILES
CC(C)CCCC(C)C1CCC2C3CC(Br)C4=C(Br)C(=O)C(Br)CC4(C)C3CCC12C
InChIKey
InChIKey=BWRSPJHBOVUNND-UHFFFAOYSA-N
Formula
C27H41Br3O
Mass
621.336
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
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Subclass
Cholestane steroids
- Level 5 Cholesterols and derivatives
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Subclass
Cholestane steroids
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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
Cholestane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Cholesterols and derivatives
Alternative Parents
Halogenated steroids 3-oxo delta-4-steroids Delta-4-steroids Cyclohexenones Alpha-haloketones Vinyl bromides Bromoalkenes Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Cholesterol-skeleton - 3-oxo-delta-4-steroid - 3-oxosteroid - 2-halo-steroid - 6-halo-steroid - 4-halo-steroid - Halo-steroid - Oxosteroid - Delta-4-steroid - Cyclohexenone - Alpha-haloketone - Cyclic ketone - Ketone - Vinyl bromide - Vinyl halide - Haloalkene - Bromoalkene - Organohalogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Alkyl halide - Alkyl bromide - Organobromide - Organooxygen compound - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as cholesterols and derivatives. These are compounds containing a 3-hydroxylated cholestane core.
External Descriptors
Not available