Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(C=NN2CN(C(CC(N)=O)C(O)=O)C(O)(CCl)N=C2N)C=C1

InChIKey

InChIKey=HSCIKFGITPWEMP-UHFFFAOYSA-N

Formula

C17H23ClN6O6

Mass

442.86

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Asparagine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Asparagine or derivatives - O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aminotriazine - Monocyclic benzene moiety - Fatty amide - 1,3,5-triazine - Fatty acyl - Triazine - Benzenoid - Carboxamide group - Chlorohydrin - Guanidine - Halohydrin - Orthocarboxylic acid derivative - Primary carboxylic acid amide - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic 1,3-dipolar compound - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Alkanolamine - Carboxylic acid - Azacycle - Ether - Organooxygen compound - Organic nitrogen compound - Alkyl chloride - Alkyl halide - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organohalogen compound - Organic oxygen compound - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as asparagine and derivatives. These are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

Previous Back Next