Compound Identification
SMILES
NC(=O)CNC(=O)C(CSC(=O)C1=CC=C(Br)C=C1)NC(=O)CCC(NC(=O)OCC1=CC=CC=C1)C(O)=O
InChIKey
InChIKey=DIHIVBNCMSVEGT-UHFFFAOYSA-N
Formula
C25H27BrN4O8S
Mass
623.48
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
-
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
Oligopeptides
Alternative Parents
Glutamine and derivatives N-acyl-alpha amino acids and derivatives Cysteine and derivatives Alpha amino acid amides Benzyloxycarbonyls 4-halobenzoic acids and derivatives Thiobenzoic acids and derivatives Benzoyl derivatives Bromobenzenes Aryl bromides N-acyl amines Carbamate esters Thioesters Primary carboxylic acid amides Secondary carboxylic acid amides Carbothioic S-esters Carboxylic acids Sulfenyl compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alpha-oligopeptide - Glutamine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Cysteine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Benzoic acid or derivatives - Thiobenzoic acid or derivatives - Benzoyl - Bromobenzene - Halobenzene - Fatty amide - Fatty acyl - N-acyl-amine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Carbamic acid ester - Carboxamide group - Carbothioic s-ester - Primary carboxylic acid amide - Secondary carboxylic acid amide - Thiocarboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid - Sulfenyl compound - Thiocarboxylic acid or derivatives - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Organic oxide - Organooxygen compound - Aromatic homomonocyclic 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