Structure Information
Structure

Compound Identification

SMILES

[Cl-].C\C=C(/C)C(=O)OC1CC[NH+]2CC=C(CO)C12

InChIKey

InChIKey=JHZIVBOZTQPAIU-JSGFVSQVSA-N

Formula

C13H20ClNO3

Mass

273.76

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Not available

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Alkaloids and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Alkaloid or derivatives - Pyrrolizine - Fatty acid ester - N-alkylpyrrolidine - Fatty acyl - 1,3-aminoalcohol - Pyrrolidine - Pyrroline - Quaternary ammonium salt - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic zwitterion - Alcohol - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Amine - Carbonyl group - Organic salt - Organic oxide - Hydrocarbon derivative - Organic chloride salt - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alkaloids and derivatives. These are naturally occurring chemical compounds that contain mostly basic nitrogen atoms. This group also includes some related compounds with neutral and even weakly acidic properties. Also some synthetic compounds of similar structure are attributed to alkaloids. In addition to carbon, hydrogen and nitrogen, alkaloids may also contain oxygen, sulfur and more rarely other elements such as chlorine, bromine, and phosphorus.

External Descriptors

Not available

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