Compound Identification
SMILES
CC(CO)CCCC(C)[C@H]1CCC2C3CCC4=CC(=O)C=C[C@]4(C)C3CC[C@]12C
InChIKey
InChIKey=HKQRQZXIXCBHRA-CUVSVWJESA-N
Formula
C27H42O2
Mass
398.631
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-1,4-steroids Delta-1,4-steroids Fatty alcohols Cyclic ketones Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
26-hydroxysteroid - Monohydroxy bile acid, alcohol, or derivatives - 3-oxo-delta-1,4-steroid - 3-oxosteroid - Oxosteroid - Delta-1,4-steroid - Fatty alcohol - Fatty acyl - Cyclic ketone - Ketone - Primary alcohol - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Alcohol - Organic oxide - Organooxygen compound - 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