Compound Identification
SMILES
CC(C)[C@@H](NC(=O)C(\NC(=O)C1=CC=C(Br)O1)=C\C1=CC=CO1)C([O-])=O
InChIKey
InChIKey=KDCZJTGZJYAWRL-KOTGUFOOSA-M
Formula
C17H16BrN2O6
Mass
424.228
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
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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
Not available
Direct Parent
Peptides
Alternative Parents
Valine and derivatives N-acyl-alpha amino acids Alpha amino acid amides 2-heteroaryl carboxamides Furoic acid and derivatives Aryl bromides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid salts Oxacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organonitrogen compounds Organic oxides Carbonyl compounds Organobromides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha peptide - Valine or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - 2-heteroaryl carboxamide - Furoic acid or derivatives - Aryl bromide - Aryl halide - Heteroaromatic compound - Furan - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Oxacycle - Carboxylic acid - Organobromide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic anion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another.
External Descriptors
Not available