Compound Identification
SMILES
CCC(CC(OC(C)=O)C(C)C1CCC2(O)C3=CC(=O)C4C(C)C(CCC4(C)C3(O)CCC12C)OC(=O)C1=CC=CC=C1)C(C)C
InChIKey
InChIKey=PRWUIQPZLAYDHH-UHFFFAOYSA-N
Formula
C39H56O7
Mass
636.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
- Subclass Stigmastanes and derivatives
-
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 Monohydroxy bile acids, alcohols and derivatives Steroid esters 14-hydroxysteroids 6-oxosteroids Delta-7-steroids Benzoic acid esters Benzoyl derivatives Cyclohexenones Dicarboxylic acids and derivatives Tertiary alcohols Cyclic alcohols and derivatives Carboxylic acid esters Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Triterpenoid - Stigmastane-skeleton - Ecdysteroid - Hydroxy bile acid, alcohol, or derivatives - Monohydroxy bile acid, alcohol, or derivatives - Bile acid, alcohol, or derivatives - Steroid ester - 14-hydroxysteroid - Hydroxysteroid - 6-oxosteroid - Oxosteroid - Delta-7-steroid - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Cyclohexenone - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Tertiary alcohol - Cyclic alcohol - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Carbonyl group - Organooxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic 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