Compound Identification
SMILES
CCC(CC(O)C(C)C1CCC2C3=CC(=O)C4C(C)C(O)CCC4(C)C3CCC12C)C(C)C
InChIKey
InChIKey=PFHQKGUFOAPKGD-UHFFFAOYSA-N
Formula
C30H50O3
Mass
458.727
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Stigmastanes and derivatives
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Class
Steroids and steroid derivatives
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Stigmastanes and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Stigmastanes and derivatives
Alternative Parents
Triterpenoids Ecdysteroids Dihydroxy bile acids, alcohols and derivatives 6-oxosteroids 3-hydroxy delta-7-steroids Delta-7-steroids Cyclohexenones Secondary alcohols Cyclic alcohols and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Triterpenoid - Stigmastane-skeleton - Ecdysteroid - Dihydroxy bile acid, alcohol, or derivatives - Hydroxy bile acid, alcohol, or derivatives - Bile acid, alcohol, or derivatives - 22-hydroxysteroid - 3-hydroxy-delta-7-steroid - 3-hydroxysteroid - 6-oxosteroid - Oxosteroid - Hydroxysteroid - Delta-7-steroid - Cyclohexenone - Cyclic alcohol - Secondary alcohol - Ketone - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Alcohol - Organic oxide - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as stigmastanes and derivatives. These are sterol lipids with a structure based on the stigmastane skeleton, which consists of a cholestane moiety bearing an ethyl group at the carbon atom C24.
External Descriptors
Not available