Compound Identification
SMILES
CCNC(=O)[C@@H](NC(=O)[C@H](C)NC[C@H](CC1=CC=CC=C1)NC(=O)C1=CC(=CC(=C1)C(=O)N[C@H](C)C1=CC=C(Br)C=C1)N1CCCOC1=O)C(C)C
InChIKey
InChIKey=DPNQTICCQZKGFY-BBQSNFNESA-N
Formula
C39H49BrN6O6
Mass
777.761
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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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
N-benzylbenzamides Valine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Alanine and derivatives Amphetamines and derivatives Benzoyl derivatives Aralkylamines Bromobenzenes 1,3-oxazinanes N-acyl amines Aryl bromides Carbamate esters Secondary carboxylic acid amides Oxacyclic compounds Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds Organobromides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - N-benzylbenzamide - 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 - Amphetamine or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Bromobenzene - Aralkylamine - Halobenzene - 1,3-oxazinane - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Fatty amide - N-acyl-amine - Benzenoid - Oxazinane - Carbamic acid ester - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Secondary aliphatic amine - Secondary amine - Azacycle - Oxacycle - Organic oxide - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Aromatic heteromonocyclic 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