Compound Identification
SMILES
CC(C)(C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](OCC1=CC=CC=C1)[C@H](O)C(=O)N[C@@H](CC(N)=O)C(=O)OCC1=CC=CC=C1
InChIKey
InChIKey=PUSGTFJZOZBFOF-LCGRTSHQSA-N
Formula
C31H40N4O8
Mass
596.681
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 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
N-acyl-alpha amino acids and derivatives Proline and derivatives Alpha amino acid esters Alpha amino acid amides Benzyloxycarbonyls Benzylethers Pyrrolidinecarboxamides N-acylpyrrolidines Fatty acid esters N-acyl amines Monosaccharides Tertiary carboxylic acid amides Secondary alcohols Carboxylic acid esters Secondary carboxylic acid amides Primary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Asparagine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Proline or derivatives - Alpha-amino acid amide - Benzyloxycarbonyl - Benzylether - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Fatty acid ester - Fatty amide - Monosaccharide - N-acyl-amine - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Secondary alcohol - Primary carboxylic acid amide - Organoheterocyclic compound - Ether - Dialkyl ether - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic 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