Compound Identification
SMILES
CCC(C)[C@H](NC(=O)CC1=CC=C(NC(=O)NC2=CC=CC=C2C)C=C1)C(=O)N1CCC(CC1)[C@H](C(O)=O)C(=O)C1=C(Cl)C=CC=C1Cl
InChIKey
InChIKey=BJQICMIEPQEMIP-IZVOWONESA-N
Formula
C36H40Cl2N4O6
Mass
695.64
Taxonomic Classification
Taxonomy Tree
-
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 Isoleucine 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
Isoleucine and derivatives
Alternative Parents
Alkyl-phenylketones N-acyl-alpha amino acids and derivatives Alpha amino acid amides Phenylpropanoic acids N-phenylureas Phenylacetamides N-acylpiperidines Aryl alkyl ketones Benzoyl derivatives Dichlorobenzenes Beta-keto acids and derivatives Toluenes Aryl chlorides Beta-hydroxy ketones 1,3-dicarbonyl compounds Tertiary carboxylic acid amides Vinylogous halides Secondary carboxylic acid amides Ureas Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organochlorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Isoleucine or derivatives - Alkyl-phenylketone - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - 3-phenylpropanoic-acid - N-phenylurea - Phenylacetamide - Phenylketone - N-acyl-piperidine - Benzoyl - 1,3-dichlorobenzene - Aryl alkyl ketone - Aryl ketone - Beta-keto acid - Chlorobenzene - Halobenzene - Toluene - 1,3-dicarbonyl compound - Benzenoid - Aryl halide - Monocyclic benzene moiety - Beta-hydroxy ketone - Aryl chloride - Keto acid - Piperidine - Tertiary carboxylic acid amide - Vinylogous halide - Secondary carboxylic acid amide - Urea - Ketone - Carboxamide group - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as isoleucine and derivatives. These are compounds containing isoleucine or a derivative thereof resulting from reaction of isoleucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available