Compound Identification
SMILES
CC1C2C(CC3C4CCC5CC(O)CCC5(C)C4CCC23CO)OC11CCC(C)CN1N=O
InChIKey
InChIKey=PWOTUOHGTGHMFC-UHFFFAOYSA-N
Formula
C27H44N2O4
Mass
460.659
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Steroidal alkaloids
- Level 5 Spirosolanes and derivatives
-
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
Spirosolanes and derivatives
Alternative Parents
18-hydroxysteroids 3-hydroxysteroids Azasteroids and derivatives Azaspirodecane derivatives Alkaloids and derivatives Nitrosopiperidines Tetrahydrofurans Secondary alcohols Organic N-nitroso compounds Cyclic alcohols and derivatives Oxacyclic compounds Azacyclic compounds Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Spirosolane skeleton - 18-hydroxysteroid - Hydroxysteroid - 3-hydroxysteroid - Azasteroid - Azaspirodecane - Alkaloid or derivatives - 1-nitrosopiperidine - Piperidine - Tetrahydrofuran - Cyclic alcohol - Organic n-nitroso compound - Secondary alcohol - Organic nitroso compound - Oxacycle - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as spirosolanes and derivatives. These are steroidal alkaloids with a structure containing a spirosolane skeleton. Siporosolane is a polycyclic compound that is characterized by a 1-oxa-6-azaspiro[4.5]decane moiety where the oxolane ring is fused to a docosahydronaphth[2,1:4',5']indene ring system. Spirosolane arises from the conversion of a cholestane side-chain into a bicyclic system containing a piperidine and a tetrahydrofuran ring.
External Descriptors
Not available