Compound Identification
SMILES
N[C@@H](CC1=CNC2=CC=CC=C12)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CNC(=O)[C@H](CC(O)=O)NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)CC1=CC(Cl)=C(Cl)C=C1
InChIKey
InChIKey=AULHBRVPNUMXDN-LPIALIDFSA-N
Formula
C48H46Cl2N6O7
Mass
889.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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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
Phenylalanine and derivatives Aspartic acid and derivatives Fluorenes N-acyl-alpha amino acids and derivatives Alpha amino acid amides Tryptamines and derivatives Amphetamines and derivatives 3-alkylindoles Dichlorobenzenes Aralkylamines Substituted pyrroles N-acyl amines Aryl chlorides Heteroaromatic compounds Carbamate esters Secondary carboxylic acid amides Amino acids Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Carbonyl compounds Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Phenylalanine or derivatives - Aspartic acid or derivatives - Fluorene - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Triptan - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - 3-alkylindole - Amphetamine or derivatives - Indole - Indole or derivatives - 1,2-dichlorobenzene - Halobenzene - Chlorobenzene - Aralkylamine - Substituted pyrrole - Fatty amide - N-acyl-amine - Aryl halide - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Fatty acyl - Heteroaromatic compound - Carbamic acid ester - Pyrrole - Amino acid or derivatives - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Primary amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Amine - Primary aliphatic amine - Aromatic 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