Compound Identification
SMILES
CC(C)(C)OC(=O)C[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)N[C@H](CCC(N)=O)C([O-])=O
InChIKey
InChIKey=AVDPHNNOSOYOHH-CABCVRRESA-M
Formula
C21H28N3O8
Mass
450.469
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
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
Glutamine and derivatives Aspartic acid and derivatives N-acyl-alpha amino acids Alpha amino acid amides Benzyloxycarbonyls Fatty acid esters N-acyl amines Dicarboxylic acids and derivatives Carbamate esters Secondary carboxylic acid amides Carboxylic acid salts Carboxylic acid esters Primary carboxylic acid amides Carboxylic acids Hydrocarbon derivatives Organic oxides Carbonyl compounds Organonitrogen compounds Organic anions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alpha-dipeptide - Glutamine or derivatives - Aspartic acid or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Fatty acid ester - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Fatty acyl - Fatty amide - N-acyl-amine - Benzenoid - Carbamic acid ester - Carboxylic acid salt - Carboxylic acid ester - Carboxamide group - Primary carboxylic acid amide - Secondary carboxylic acid amide - Carboxylic acid - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic anion - Aromatic homomonocyclic 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