Compound Identification
SMILES
Cl.CC1CNC2C(C)C3C(CC4C5CCC6CC(N)CCC6(C)C5CCC34C)OC2(O)C1
InChIKey
InChIKey=QISMHSAAOCJSEJ-UHFFFAOYSA-N
Formula
C27H47ClN2O2
Mass
467.14
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Steroidal alkaloids
- Level 5 Solanocapsine-type alkaloids
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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
Solanocapsine-type alkaloids
Alternative Parents
Hydroxysteroids Azasteroids and derivatives Alkaloids and derivatives Piperidines Oxanes Hemiacetals Oxacyclic compounds Dialkylamines Azacyclic compounds Monoalkylamines Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Solanocapsine skeleton - 23-hydroxysteroid - Hydroxysteroid - Azasteroid - Alkaloid or derivatives - Oxane - Piperidine - Hemiacetal - Organoheterocyclic compound - Oxacycle - Secondary amine - Secondary aliphatic amine - Azacycle - Primary amine - Amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Hydrochloride - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as solanocapsine-type alkaloids. These are steroidal alkaloids with a structure that is characterized by a docosahydronaphth[2,1:4',5']indene ring system fused to a pyrano[3,2-b]pyridine moiety.
External Descriptors
Not available