Compound Identification
SMILES
CC(COS([O-])(=O)=O)C\C=C\[C@@H](C)[C@H]1CCC2C3=CC(=O)[C@H]4C[C@H](O)CC[C@]4(C)C3CC[C@]12C
InChIKey
InChIKey=KDUVNRKZGYTTJS-NZUZQIPGSA-M
Formula
C27H41O6S
Mass
493.68
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
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
Ecdysteroids 6-oxosteroids 3-hydroxy delta-7-steroids 3-alpha-hydroxysteroids Delta-7-steroids Cyclohexenones Sulfuric acid monoesters Alkyl sulfates Secondary alcohols Cyclic alcohols and derivatives Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Cholesterol-skeleton - Ecdysteroid - 3-hydroxy-delta-7-steroid - 3-hydroxysteroid - 6-oxosteroid - 3-alpha-hydroxysteroid - Hydroxysteroid - Oxosteroid - Delta-7-steroid - Cyclohexenone - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Cyclic alcohol - Organic sulfuric acid or derivatives - Ketone - Secondary alcohol - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Alcohol - Organic oxide - Organooxygen compound - Organic anion - 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