Compound Identification
SMILES
[Na+].NC(=O)C1=C[N+](CC(=O)N2CC[C@@H]3[C@H]2C(=O)N3S([O-])(=O)=O)=CC=C1
InChIKey
InChIKey=JZCGPBYKVVWUII-XQKZEKTMSA-N
Formula
C13H14N4NaO6S
Mass
377.33
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
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
Nicotinamides N-acylpyrrolidines 1,4-diazepanes Pyridinium derivatives Vinylogous amides Tertiary carboxylic acid amides Organic sulfuric acids and derivatives Beta lactams Heteroaromatic compounds Tertiary amines Primary carboxylic acid amides Azetidines Azacyclic compounds Organic sodium salts Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Nicotinamide - Pyridine carboxylic acid or derivatives - N-acylpyrrolidine - 1,4-diazepane - Diazepane - Pyridine - Pyridinium - Vinylogous amide - Tertiary carboxylic acid amide - Pyrrolidine - Beta-lactam - Heteroaromatic compound - Organic sulfuric acid or derivatives - Azetidine - Tertiary amine - Carboxamide group - Primary carboxylic acid amide - Lactam - Organoheterocyclic compound - Organic alkali metal salt - Azacycle - Organic salt - Organic sodium salt - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Amine - 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