Compound Identification
SMILES
CC(C)CC(NC(CC(=O)NC1=NC2=CC(Cl)=C(Cl)C=C2S1)C(O)=O)C(O)=O
InChIKey
InChIKey=XUMAPQZKLQTYRK-UHFFFAOYSA-N
Formula
C17H19Cl2N3O5S
Mass
448.32
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
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Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Leucine 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
Leucine and derivatives
Alternative Parents
Asparagine and derivatives Alpha amino acids Benzothiazoles N-arylamides Aryl chlorides Fatty amides Dicarboxylic acids and derivatives Benzenoids Thiazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Dialkylamines Azacyclic compounds Carboxylic acids Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Asparagine or derivatives - Leucine or derivatives - Alpha-amino acid - 1,3-benzothiazole - N-arylamide - Aryl chloride - Fatty amide - Fatty acyl - Benzenoid - Dicarboxylic acid or derivatives - Aryl halide - Azole - Heteroaromatic compound - Thiazole - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Carboxylic acid - Secondary aliphatic amine - Secondary amine - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as leucine and derivatives. These are compounds containing leucine or a derivative thereof resulting from reaction of leucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available