Compound Identification
SMILES
NC1=NC2=C(S1)C=C(C=C2)[C@H](NC(=O)N1CC(\N=C2\COC=C2)=NC1=O)C(O)=O
InChIKey
InChIKey=JCZZOAVADGENNZ-PFHXIJNMSA-N
Formula
C17H14N6O5S
Mass
414.4
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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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 - Alpha amino acids and derivatives - N-carbamoyl-alpha amino acids and derivatives
Direct Parent
N-carbamoyl-alpha amino acids
Alternative Parents
Benzothiazoles 2-amino-1,3-thiazoles Primary aromatic amines Benzenoids Secondary ketimines Azomethines Imidazolines Dihydrofurans Heteroaromatic compounds Ureas Amino acids Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-carbamoyl-alpha-amino acid - 1,3-benzothiazole - Primary aromatic amine - Benzenoid - 1,3-thiazol-2-amine - Azole - Azomethine - Dihydrofuran - 3-imidazoline - Secondary ketimine - Thiazole - Heteroaromatic compound - Urea - Amino acid - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Amine - Organooxygen compound - Primary amine - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-carbamoyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an carbamoyl group at its terminal nitrogen atom.
External Descriptors
Not available