Compound Identification
SMILES
CC(C1CCC2C3CC(=O)C4CC(O)CCC4(C)C3CCC12C)C1=NCC(C)CC1
InChIKey
InChIKey=QAGPPGDCPAPQLW-UHFFFAOYSA-N
Formula
C27H43NO2
Mass
413.646
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Gluco/mineralocorticoids, progestogins and derivatives 6-oxosteroids 3-hydroxysteroids Tetrahydropyridines Secondary alcohols Ketones Ketimines Cyclic alcohols and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
22,26-epiminocholestane skeleton - Progestogin-skeleton - Pregnane-skeleton - 3-hydroxysteroid - Hydroxysteroid - Oxosteroid - 6-oxosteroid - Tetrahydropyridine - Hydropyridine - Cyclic alcohol - Secondary alcohol - Ketimine - Ketone - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organonitrogen compound - Imine - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Organooxygen compound - Carbonyl group - Alcohol - Organic oxygen 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