Compound Identification
SMILES
[Na+].SC=C=C(S)OC=O.CC(=O)N[C@H]1[C@@H]2SC(C)(C)C(N2C1=O)C([O-])=O
InChIKey
InChIKey=HYFVAMAUUFOSGH-CRQKATBGSA-M
Formula
C14H17N2NaO6S3
Mass
428.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
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Level 5
Peptides
- Level 6 Dipeptides
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Level 5
Peptides
-
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
Peptides
Direct Parent
Dipeptides
Alternative Parents
Penicillins N-acyl-alpha amino acids and derivatives Acetamides Thiazolidines Tertiary carboxylic acid amides Secondary carboxylic acid amides Azetidines Carboxylic acid esters Carboxylic acid salts Thiohemiaminal derivatives Alkylthiols Azacyclic compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Organic sodium salts Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives Organic zwitterions Organic oxides
Molecular Framework
Not available
Substituents
Alpha-dipeptide - Penicillin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Penam - Beta-lactam - Tertiary carboxylic acid amide - Thiazolidine - Acetamide - Azetidine - Carboxamide group - Carboxylic acid ester - Carboxylic acid salt - Lactam - Secondary carboxylic acid amide - Organoheterocyclic compound - Organic alkali metal salt - Dialkylthioether - Azacycle - Hemithioaminal - Thioether - Alkylthiol - Carboxylic acid - Monocarboxylic acid or derivatives - Organic sodium salt - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic zwitterion - Carbonyl group - Organic salt - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
External Descriptors
Not available