Compound Identification
SMILES
CC(C)[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)N[C@@H](C)C(=O)N[C@@H](OCC=O)C(=O)COC(=O)C1=C(Cl)C=CC=C1Cl
InChIKey
InChIKey=ABGURXXQCVTOBD-RUJAXMSRSA-N
Formula
C28H31Cl2N3O9
Mass
624.47
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
-
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
Valine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Alanine and derivatives Benzoic acid esters 2-halobenzoic acids and derivatives Benzyloxycarbonyls Benzoyl derivatives Dichlorobenzenes N-acyl amines Monosaccharides Aryl chlorides Carbamate esters Vinylogous halides Carboxylic acid esters Secondary carboxylic acid amides Ketones Hydrocarbon derivatives Organic oxides Aldehydes Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alpha-dipeptide - Valine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alanine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzoate ester - Benzyloxycarbonyl - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - 1,3-dichlorobenzene - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-acyl-amine - Monosaccharide - Fatty acyl - Fatty amide - Carbamic acid ester - Vinylogous halide - Secondary carboxylic acid amide - Ketone - Carboxamide group - Carboxylic acid ester - Aldehyde - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - 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