Structure Information
Structure

Compound Identification

SMILES

[Na+].C[C@@H](NC(=O)[C@@H](O)[C@H]1[C@@H]2N([C@@H](C([O-])=O)C(C)(C)S2(=O)=O)C1=O)C1=CC=CC=C1

InChIKey

InChIKey=DFDBTKAGVUYKSR-DFCMBRMOSA-M

Formula

C18H21N2NaO7S

Mass

432.42

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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

Direct Parent

Alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid or derivatives - Penam - Monocyclic benzene moiety - Benzenoid - Beta-lactam - Sulfone - Tertiary carboxylic acid amide - Thiazolidine - Azetidine - Carboxamide group - Carboxylic acid salt - Lactam - Secondary alcohol - Secondary carboxylic acid amide - Organoheterocyclic compound - Organic alkali metal salt - Azacycle - Carboxylic acid - Monocarboxylic acid or derivatives - Organic salt - Organic oxide - Organonitrogen compound - Alcohol - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic sodium salt - Organic cation - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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