Compound Identification
SMILES
CC(C)(C)NC(=O)N(C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](N)CC(N)=O)CC1=CC=NC=C1
InChIKey
InChIKey=ICIBXNKVQQNLAY-PCCBWWKXSA-N
Formula
C25H36N6O4
Mass
484.601
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
-
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
Alpha amino acid amides Phenylbutylamines Amphetamines and derivatives Pyridines and derivatives N-acyl amines Heteroaromatic compounds Ureas Secondary carboxylic acid amides Secondary alcohols Primary carboxylic acid amides Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Asparagine or derivatives - Alpha-amino acid amide - Phenylbutylamine - Amphetamine or derivatives - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Fatty acyl - Benzenoid - Pyridine - Heteroaromatic compound - Carboxamide group - Primary carboxylic acid amide - Urea - Secondary alcohol - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Primary amine - Organic nitrogen compound - Amine - Organic oxygen 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