Compound Identification
SMILES
CC(C1C(O)CC2C3CC=C4CC(O)CCC4(C)C3CCC12C)C1CCC(C)CN1C(C)=O
InChIKey
InChIKey=DLXYWVPYQPBPJB-UHFFFAOYSA-N
Formula
C29H47NO3
Mass
457.699
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Steroidal alkaloids
- Level 5 22,26-epiminocholestanes
-
Subclass
Steroidal alkaloids
-
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
Gluco/mineralocorticoids, progestogins and derivatives 3-hydroxy delta-5-steroids 16-hydroxysteroids Delta-5-steroids N-acylpiperidines Tertiary carboxylic acid amides Acetamides Secondary alcohols Cyclic alcohols and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
22,26-epiminocholestane skeleton - Progestogin-skeleton - Pregnane-skeleton - 3-hydroxy-delta-5-steroid - 3-hydroxysteroid - 16-hydroxysteroid - Hydroxysteroid - Delta-5-steroid - N-acyl-piperidine - Piperidine - Cyclic alcohol - Acetamide - Tertiary carboxylic acid amide - Carboxamide group - Secondary alcohol - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Alcohol - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - 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