Compound Identification
SMILES
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2C3=C(CC(=O)[C@]12C)[C@@]1(C)CC[C@@H](O)C[C@H]1CC3
InChIKey
InChIKey=CNSBFFAXUYPWRQ-YLDMDQPTSA-N
Formula
C24H36O4
Mass
388.548
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
Monohydroxy bile acids, alcohols and derivatives
Alternative Parents
Oxosteroids 3-alpha-hydroxysteroids Cyclohexenones Secondary alcohols Cyclic alcohols and derivatives Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Monohydroxy bile acid, alcohol, or derivatives - 3-hydroxysteroid - Hydroxysteroid - 12-oxosteroid - Oxosteroid - 3-alpha-hydroxysteroid - Cyclohexenone - Cyclic alcohol - Ketone - Secondary alcohol - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Carbonyl group - Organooxygen compound - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as monohydroxy bile acids, alcohols and derivatives. These are bile acids, alcohols or any of their derivatives bearing a hydroxyl group.
External Descriptors
LIPIDMAPS (LMST04010380) : C24 bile acids, alcohols, and derivatives