Compound Identification
SMILES
C[C@@H](O)[C@@H]1[C@H]2S[C@@H](S[C@@H]3CNC(CC#N)=NC3)[C@@H](N2C1=O)C(O)=O
InChIKey
InChIKey=BXHGDDMMHURAGC-GVRGLSQASA-N
Formula
C14H18N4O4S2
Mass
370.44
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
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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 Hydropyrimidines Imidolactams Thiazolidines Tertiary carboxylic acid amides Dithioacetals Azetidines Secondary alcohols Azacyclic compounds Thiohemiaminal derivatives Carboxamidines Carboximidamides Nitriles Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Dialkylthioethers Carboxylic acids Carbonyl compounds Organic oxides Amines Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Penam - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Imidolactam - Beta-lactam - Thioacetal - Tertiary carboxylic acid amide - Thiazolidine - Azetidine - Carboxamide group - Lactam - Secondary alcohol - Amidine - Carboxylic acid amidine - Carboxylic acid - Azacycle - Organoheterocyclic compound - Dialkylthioether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Hemithioaminal - Thioether - Carboximidamide - Cyanide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Amine - Organic oxygen compound - Aliphatic 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