Compound Identification
SMILES
CCCCCC(=O)OC1CC[C@]2(C)C3CC[C@@]4(C)C(CC5OC6(CCC(C)CN6C(C)=O)C(C)C45)C3CC=C2C1
InChIKey
InChIKey=WMEZNRKNUCPQAD-LCOUGZJWSA-N
Formula
C35H55NO4
Mass
553.828
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
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Subclass
Steroidal alkaloids
- Level 5 Spirosolanes and derivatives
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Subclass
Steroidal alkaloids
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Class
Steroids and steroid derivatives
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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
Steroid esters Azasteroids and derivatives Delta-5-steroids Azaspirodecane derivatives Alkaloids and derivatives N-acylpiperidines Fatty acid esters Acetamides Oxolanes Tertiary carboxylic acid amides Carboxylic acid esters Tertiary amines Amino acids and derivatives Monocarboxylic acids and derivatives Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Spirosolane skeleton - Steroid ester - Azasteroid - Delta-5-steroid - Azaspirodecane - N-acyl-piperidine - Alkaloid or derivatives - Fatty acid ester - Piperidine - Fatty acyl - Oxolane - Acetamide - Tertiary carboxylic acid amide - Amino acid or derivatives - Tertiary amine - Carboxamide group - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - 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