Structure Information
Structure

Compound Identification

SMILES

C[C@H](NC1=CC=CC=C1C(=O)OC(C)(C)C)C(O)=O

InChIKey

InChIKey=VXHDHFIXTVVHFI-VIFPVBQESA-N

Formula

C14H19NO4

Mass

265.309

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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

Alanine and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Alanine or derivatives - Alpha-amino acid - Aminobenzoic acid or derivatives - Benzoate ester - L-alpha-amino acid - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Phenylalkylamine - Secondary aliphatic/aromatic amine - Benzenoid - Monocyclic benzene moiety - Vinylogous amide - Amino acid - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid - Secondary amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as alanine and derivatives. These are compounds containing alanine or a derivative thereof resulting from reaction of alanine 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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