Compound Identification
SMILES
CC(C)(O)CCC(O)C(C)(O)C1CC=C2C3=C(CCC12C)C1(C)CC(O)C(O)CC1C(N)C3
InChIKey
InChIKey=GKCWASRAHFRFBX-UHFFFAOYSA-N
Formula
C27H45NO5
Mass
463.659
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
Pentahydroxy bile acids, alcohols and derivatives
Alternative Parents
Cholesterols and derivatives 3-hydroxysteroids Tertiary alcohols Secondary alcohols Cyclic alcohols and derivatives Polyols Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Cholesterol-skeleton - Pentahydroxy bile acid, alcohol, or derivatives - Cholestane-skeleton - 25-hydroxysteroid - 22-hydroxysteroid - 20-hydroxysteroid - 3-hydroxysteroid - 2-hydroxysteroid - Hydroxysteroid - Cyclic alcohol - Tertiary alcohol - Secondary alcohol - Polyol - Organonitrogen compound - Primary aliphatic amine - Primary amine - Alcohol - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Amine - Organooxygen compound - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as pentahydroxy bile acids, alcohols and derivatives. These are bile acids, alcohols or derivatives bearing five hydroxyl groups.
External Descriptors
Not available