Compound Identification
SMILES
NC(N)=NCCC[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)C1=CC(Br)=CC=C1)C(=O)N[C@H](CC1=CC=C(Cl)C=C1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC1=CNC2=CC=CC=C12)C(N)=O
InChIKey
InChIKey=BNUXWULSUWJMQG-ALJNDBQTSA-N
Formula
C42H53BrClN13O6S
Mass
983.39
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 Oligopeptides
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Level 5
Peptides
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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
Oligopeptides
Alternative Parents
Phenylalanine and derivatives Hippuric acids and derivatives N-acyl-alpha amino acids and derivatives Tryptamines and derivatives Cysteine and derivatives Alpha amino acid amides 3-alkylindoles Amphetamines and derivatives 3-halobenzoic acids and derivatives Benzoyl derivatives Chlorobenzenes Bromobenzenes N-acyl amines Aryl bromides Substituted pyrroles Aryl chlorides Heteroaromatic compounds Guanidines Primary carboxylic acid amides Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Alkylthiols Carboximidamides Azacyclic compounds Organic oxides Hydrocarbon derivatives Organochlorides Organobromides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-oligopeptide - Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid amide - Cysteine or derivatives - Triptan - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3-alkylindole - Benzamide - Indole or derivatives - Benzoic acid or derivatives - Indole - Benzoyl - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Fatty amide - Benzenoid - Substituted pyrrole - N-acyl-amine - Pyrrole - Heteroaromatic compound - Primary carboxylic acid amide - Guanidine - Secondary carboxylic acid amide - Carboxamide group - Carboximidamide - Alkylthiol - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as oligopeptides. These are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds.
External Descriptors
Not available