Structure Information
Structure

Compound Identification

SMILES

COC(=O)C[C@H](NC(=O)CN1C=C(F)C(=O)NC1=O)C(=O)OC

InChIKey

InChIKey=VJYMQKRROMRBBM-ZETCQYMHSA-N

Formula

C12H14FN3O7

Mass

331.256

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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

Aspartic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aspartic acid or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Halopyrimidine - Fatty acid ester - Pyrimidone - Fatty acid methyl ester - Aryl fluoride - Hydropyrimidine - Aryl halide - Pyrimidine - Dicarboxylic acid or derivatives - Fatty acyl - Heteroaromatic compound - Methyl ester - Vinylogous amide - Secondary carboxylic acid amide - Urea - Carboxylic acid ester - Carboxamide group - Lactam - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic compound

Description

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

External Descriptors

Not available

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