Structure Information
Structure

Compound Identification

SMILES

CC1C2C(CC3[C@H]4CC=C5C[C@@H](CC[C@@]5(C)C4CC[C@@]23C)OC(C)=O)O[C@]11CCC(C)CN1

InChIKey

InChIKey=MCQNPWNREVNWDQ-CJHCULCJSA-N

Formula

C29H45NO3

Mass

455.683

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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 - Steroid ester - Azasteroid - Delta-5-steroid - Azaspirodecane - Alkaloid or derivatives - Piperidine - Tetrahydrofuran - Amino acid or derivatives - Carboxylic acid ester - Hemiaminal - Organoheterocyclic compound - Secondary amine - Azacycle - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Hydrocarbon derivative - Organopnictogen compound - Amine - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - 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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