Compound Identification
SMILES
CC(C)C(C)(C)C(\C)=C\C[C@@H](C)[C@H]1CCC2C3C[C@H](OS(O)(=O)=O)C4C[C@H](OS(O)(=O)=O)[C@H](C[C@]4(C)C3CC[C@]12C)OS(O)(=O)=O
InChIKey
InChIKey=XXSWYTSITMIFFJ-QNOOWDOTSA-N
Formula
C31H54O12S3
Mass
714.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Ergostane steroids
-
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
Ergostane steroids
Intermediate Tree Nodes
Not available
Direct Parent
Ergostane steroids
Alternative Parents
Sulfated steroids Sulfuric acid monoesters Alkyl sulfates Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Ergostane-skeleton - Sulfated steroid skeleton - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Sulfuric acid monoester - Organic sulfuric acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as ergostane steroids. These are steroids with a structure based on the ergostane skeleton, which arises from the methylation of cholestane at the 24-position.
External Descriptors
Not available