Structure Information
Structure

Compound Identification

SMILES

CC1C2C(CC3C4CCC5CC(O)CCC5(C)C4CCC23CO)OC11CCC(C)CN1N=O

InChIKey

InChIKey=PWOTUOHGTGHMFC-UHFFFAOYSA-N

Formula

C27H44N2O4

Mass

460.659

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Taxonomic Classification

Taxonomy Tree

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

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

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