Compound Identification
SMILES
C[C@H](C[C@@H](O)C(O)=O)[C@@]1(O)CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
InChIKey
InChIKey=ALYJFBCWXLPJMU-OURYSSJNSA-N
Formula
C24H40O6
Mass
424.578
Taxonomic Classification
Taxonomy Tree
- Kingdom Organic compounds
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Bile acids, alcohols and derivatives
Intermediate Tree Nodes
Hydroxy bile acids, alcohols and derivatives
Direct Parent
Tetrahydroxy bile acids, alcohols and derivatives
Alternative Parents
7-hydroxysteroids 3-alpha-hydroxysteroids 17-hydroxysteroids Alpha hydroxy acids and derivatives Tertiary alcohols Secondary alcohols Cyclic alcohols and derivatives Polyols Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Tetrahydroxy bile acid, alcohol, or derivatives - 23-hydroxysteroid - 3-hydroxysteroid - 7-hydroxysteroid - 17-hydroxysteroid - 3-alpha-hydroxysteroid - Hydroxysteroid - Alpha-hydroxy acid - Hydroxy acid - Cyclic alcohol - Tertiary alcohol - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Polyol - Monocarboxylic acid or derivatives - Alcohol - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetrahydroxy bile acids, alcohols and derivatives. These are prenol lipids structurally characterized by a bile acid or alcohol which bears four hydroxyl groups.
External Descriptors
LIPIDMAPS (LMST04010421) : C24 bile acids, alcohols, and derivatives