Compound Identification
SMILES
CC(C)C[NH2+][C@H](CC(=O)NC1=CC(Cl)=CC=C1)C([O-])=O
InChIKey
InChIKey=MMYYFFRXDXFILH-GFCCVEGCSA-N
Formula
C14H19ClN2O3
Mass
298.77
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
-
Level 6
Alpha amino acids and derivatives
- Level 7 Asparagine and derivatives
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Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
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
Asparagine and derivatives
Alternative Parents
D-alpha-amino acids Anilides N-arylamides Chlorobenzenes Aryl chlorides Fatty amides Quaternary ammonium salts Secondary carboxylic acid amides Carboxylic acid salts Carboxylic acids Monocarboxylic acids and derivatives Dialkylamines Hydrocarbon derivatives Organic oxides Organic salts Carbonyl compounds Organic zwitterions Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Asparagine or derivatives - Alpha-amino acid - D-alpha-amino acid - Anilide - N-arylamide - Halobenzene - Chlorobenzene - Aryl chloride - Fatty amide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Quaternary ammonium salt - Secondary carboxylic acid amide - Carboxylic acid salt - Carboxamide group - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as asparagine and derivatives. These are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available