Compound Identification
SMILES
CC(=O)N[N+]12[C@@H](CC1=O)SC(C)(C)[C@@]2(C(O)=O)C1=NC(N)=CS1
InChIKey
InChIKey=VWLIULLILLUSQC-BVBNVVFCSA-O
Formula
C13H17N4O4S2
Mass
357.42
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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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
Penams 2,4-disubstituted thiazoles Aminothiazoles Imidolactams Diacylhydrazines Thiazolidines Acetamides Heteroaromatic compounds Amino acids Azetidines Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Dialkylthioethers Organic oxides Hydrocarbon derivatives Carbonyl compounds Primary amines Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Penam - 2,4-disubstituted 1,3-thiazole - Diacylhydrazine - 1,3-thiazolamine - Imidolactam - Beta-lactam - Thiazole - Thiazolidine - Azole - Acetamide - Heteroaromatic compound - Carboxylic acid hydrazide - Azetidine - Amino acid - Lactam - Thioether - Carboxylic acid - Monocarboxylic acid or derivatives - Dialkylthioether - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Primary amine - Hydrocarbon derivative - Organic oxide - 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