Compound Identification
SMILES
CC(CCC(O)=O)C1CCC2C3CC=C4C(C)(C)C(=O)C(O)=CC4(C)C3CC(=O)C12C
InChIKey
InChIKey=MDIUAOCBRNSEMF-UHFFFAOYSA-N
Formula
C26H36O5
Mass
428.569
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
Hydroxysteroids 3-oxo delta-1-steroids Delta-1-steroids Cyclohexenones Monocarboxylic acids and derivatives Enols Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Monohydroxy bile acid, alcohol, or derivatives - 3-oxo-delta-1-steroid - 3-oxosteroid - 2-hydroxysteroid - Oxosteroid - 12-oxosteroid - Hydroxysteroid - Delta-1-steroid - Cyclohexenone - Cyclic ketone - Ketone - Enol - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - 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
Not available