Compound Identification
SMILES
COC(=O)CCC(C)C1CCC2C3CCC4CC(O)CCC4(C)C3CC(OC(C)=O)C12C
InChIKey
InChIKey=WVUYDAPOQCJLRI-UHFFFAOYSA-N
Formula
C27H44O5
Mass
448.644
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
Steroid esters 3-hydroxysteroids Fatty acid methyl esters Dicarboxylic acids and derivatives Methyl esters Secondary alcohols Cyclic alcohols and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Monohydroxy bile acid, alcohol, or derivatives - Steroid ester - 3-hydroxysteroid - Hydroxysteroid - Fatty acid ester - Fatty acid methyl ester - Fatty acyl - Dicarboxylic acid or derivatives - Cyclic alcohol - Methyl ester - Secondary alcohol - Carboxylic acid ester - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Alcohol - 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