Structure Information
Structure

Compound Identification

SMILES

CC(C)CC(=O)O[C@@H]1CC2C[C@@H](O)C(C1)N2C

InChIKey

InChIKey=APLLVFVOTXZBFO-RUJICJSRSA-N

Formula

C13H23NO3

Mass

241.331

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Tropane alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Tropane alkaloids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Tropane alkaloid - Fatty acid ester - Piperidine - N-alkylpyrrolidine - Fatty acyl - Cyclic alcohol - Pyrrolidine - Amino acid or derivatives - Carboxylic acid ester - 1,2-aminoalcohol - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Amine - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as tropane alkaloids. These are organic compounds containing the nitrogenous bicyclic alkaloid parent N-Methyl-8-azabicyclo[3.2.1]octane.

External Descriptors

CHEBI:9923 : tropane alkaloid
KEGG (C10869) : Tropane alkaloids

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