Structure Information
Structure

Compound Identification

SMILES

CC1C2C(CC3C4CC=C5CC(CC[C@]5(C)C4CC[C@]23C)OC(=O)C2=CC=CC=C2)OC11CCC(C)CN1C(C)=O

InChIKey

InChIKey=PXHHDOYCNJULEB-DRECWGGYSA-N

Formula

C36H49NO4

Mass

559.791

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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

Aromatic heteropolycyclic compounds

Substituents

Spirosolane skeleton - Azasteroid - Delta-5-steroid - Azaspirodecane - Benzoate ester - Benzoic acid or derivatives - Alkaloid or derivatives - N-acyl-piperidine - Benzoyl - Monocyclic benzene moiety - Benzenoid - Piperidine - Acetamide - Oxolane - Tertiary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Amine - Aromatic 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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