Compound Identification
SMILES
CC(C)(C)OC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)OCC1=CC=CC=C1)CC(=O)N[C@@H](COCC1=CC=CC=C1)CC(=O)OCC(Cl)(Cl)Cl)C(=O)OCC1=CC=CC=C1
InChIKey
InChIKey=AAKKFDMDCDTJLF-GMTSZFNJSA-N
Formula
C42H50Cl3N3O11
Mass
879.22
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
-
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
Alpha amino acid esters Beta amino acids and derivatives Benzyloxycarbonyls Tricarboxylic acids and derivatives Benzylethers Fatty acid esters N-acyl amines Carbamate esters Secondary carboxylic acid amides Carboxylic acid esters Dialkyl ethers Alkyl chlorides Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Asparagine or derivatives - Alpha-amino acid ester - Beta amino acid or derivatives - Benzyloxycarbonyl - Benzylether - Tricarboxylic acid or derivatives - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Fatty amide - N-acyl-amine - Benzenoid - Carbamic acid ester - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Dialkyl ether - Ether - Organochloride - Alkyl halide - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Alkyl chloride - 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