Compound Identification
SMILES
CN(CC1=CC=CC=C1)C(=O)[C@@H](CC(O)=O)NC(=O)CCC(NC(=O)C1=CC(Cl)=CC(Cl)=C1)C(=O)N1CCC2(CCCC2)CC1
InChIKey
InChIKey=GCKJLORRSPKGPL-SSYAZFEXSA-N
Formula
C33H40Cl2N4O6
Mass
659.61
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 Aspartic acid 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
Aspartic acid and derivatives
Alternative Parents
Hippuric acids and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides 3-halobenzoic acids and derivatives Azaspirodecane derivatives N-acylpiperidines Dichlorobenzenes Benzoyl derivatives N-acyl amines Aryl chlorides Tertiary carboxylic acid amides Secondary carboxylic acid amides Tertiary amines Amino acids Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aspartic acid or derivatives - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Azaspirodecane - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - N-acyl-piperidine - 1,3-dichlorobenzene - Benzoyl - Chlorobenzene - Halobenzene - Fatty acyl - Fatty amide - N-acyl-amine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Piperidine - Tertiary carboxylic acid amide - Amino acid - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aspartic acid and derivatives. These are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available