Compound Identification
SMILES
CC(C1C(CC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(C)=O)OC(C)=O)C1=NCC(C)CC1
InChIKey
InChIKey=DQCWPGBLFVRMDS-UHFFFAOYSA-N
Formula
C31H47NO4
Mass
497.72
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
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Subclass
Steroidal alkaloids
- Level 5 22,26-epiminocholestanes
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Subclass
Steroidal alkaloids
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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
Steroidal alkaloids
Intermediate Tree Nodes
Not available
Direct Parent
22,26-epiminocholestanes
Alternative Parents
Steroid esters Pregnane steroids Delta-5-steroids Tetrahydropyridines Dicarboxylic acids and derivatives Ketimines Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
22,26-epiminocholestane skeleton - Steroid ester - Pregnane-skeleton - Delta-5-steroid - Tetrahydropyridine - Dicarboxylic acid or derivatives - Hydropyridine - Carboxylic acid ester - Ketimine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organonitrogen compound - Imine - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organopnictogen compound - Carbonyl group - Organic oxide - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 22,26-epiminocholestanes. These are steroid alkaloids obtained by reduction of spirosolane through opening of the E-ring.
External Descriptors
Not available