Compound Identification
SMILES
CC(C)OC(=O)C1=C(C)N(CC2=CC(Cl)=CC(Cl)=C2)C(C(O)=O)=C(C1C1=CC=CC=C1Cl)C(O)=O
InChIKey
InChIKey=CPPZJRWRBVDTJY-UHFFFAOYSA-N
Formula
C25H22Cl3NO6
Mass
538.8
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 Alpha amino acids
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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
Alpha amino acids
Alternative Parents
Tricarboxylic acids and derivatives Dihydropyridinecarboxylic acids and derivatives Phenylmethylamines Benzylamines Dichlorobenzenes Aralkylamines Aryl chlorides Vinylogous amides Enoate esters Trialkylamines Amino acids Azacyclic compounds Enamines Carboxylic acids Organochlorides Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid - Dihydropyridinecarboxylic acid derivative - Tricarboxylic acid or derivatives - 1,3-dichlorobenzene - Phenylmethylamine - Benzylamine - Halobenzene - Dihydropyridine - Chlorobenzene - Aralkylamine - Monocyclic benzene moiety - Hydropyridine - Aryl halide - Benzenoid - Aryl chloride - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Amino acid - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid - Enamine - Organooxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
External Descriptors
Not available