Compound Identification
SMILES
NC(=O)C[C@H](NC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl)C(O)=O
InChIKey
InChIKey=MAFZCJYXXXYFJK-ZDUSSCGKSA-N
Formula
C16H21Cl2N3O4
Mass
390.26
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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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
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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
N-acyl-L-alpha-amino acids Phenylacetamides Aniline and substituted anilines Dialkylarylamines Nitrogen mustard compounds Fatty amides Secondary carboxylic acid amides Primary carboxylic acid amides Amino acids Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Alkyl chlorides Carbonyl compounds Organochlorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Asparagine or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - N-acyl-l-alpha-amino acid - Phenylacetamide - Nitrogen mustard - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Monocyclic benzene moiety - Fatty amide - Benzenoid - Fatty acyl - Tertiary amine - Amino acid - Secondary carboxylic acid amide - Primary carboxylic acid amide - Carboxamide group - Carboxylic acid - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Alkyl halide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Alkyl chloride - Organic oxide - 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