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Structure Information
Structure

Compound Identification

SMILES

COC1=C(COC2=CC=CC=C2F)C=C(C=C1)C1NC(CC2=C1N=CN2)C(O)=O

InChIKey

InChIKey=DSBIRTBUTMGDJM-UHFFFAOYSA-N

Formula

C21H20FN3O4

Mass

397.406

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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

Alpha amino acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid - Imidazopyridine - Imidazopiperidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Halobenzene - Fluorobenzene - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Aryl fluoride - Aryl halide - Imidazole - Azole - Heteroaromatic compound - Amino acid - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid - Secondary aliphatic amine - Ether - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Amine - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).

External Descriptors

Not available

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