Compound Identification
SMILES
OC(=O)C1N2C(CN1C(=O)CBr)[C@@H](NC(=O)COC1=CC=CC=C1)C2=O
InChIKey
InChIKey=CYKCBISIWSBIRX-IWXRYERYSA-N
Formula
C16H16BrN3O6
Mass
426.223
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 Amino acids and derivatives
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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
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Phenoxy compounds Phenol ethers 1,3-diazepanes Alkyl aryl ethers Tertiary carboxylic acid amides Imidazolidines Beta lactams Tertiary amines Secondary carboxylic acid amides Amino acids Azetidines Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Alkyl bromides Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Phenoxy compound - Phenol ether - 1,3-diazepane - Alkyl aryl ether - Diazepane - Monocyclic benzene moiety - Benzenoid - Beta-lactam - Imidazolidine - Tertiary carboxylic acid amide - Tertiary amine - Azetidine - Carboxamide group - Amino acid - Lactam - Secondary carboxylic acid amide - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid - Ether - Hydrocarbon derivative - Alkyl halide - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Organic oxide - Alkyl bromide - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available