Structure Information
Structure

Compound Identification

SMILES

CCC(=O)O[C@H]1CC[C@]2(C)C3CC[C@@]4(C)C(CC5OC6(CCC(C)CN6C(C)=O)C(C)C45)C3CC=C2C1

InChIKey

InChIKey=JYWMKRQVORLJFE-LKSYCQBPSA-N

Formula

C32H49NO4

Mass

511.747

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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 - N-acyl-piperidine - Alkaloid or derivatives - Piperidine - Oxolane - Acetamide - Tertiary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Amine - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - 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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