Compound Identification
SMILES
NC1=NC(=O)C2=NC(CCOC3=CC=C(C=C3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=CN=C2N1
InChIKey
InChIKey=KIWDKYBQSARKOL-ZDUSSCGKSA-N
Formula
C20H20N6O7
Mass
456.415
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 Glutamic acid and derivatives
-
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
Glutamic acid and derivatives
Alternative Parents
Hippuric acids N-acyl-alpha amino acids Pterins and derivatives Benzoyl derivatives Phenoxy compounds Phenol ethers Pyrimidones Alkyl aryl ethers Aminopyrimidines and derivatives Dicarboxylic acids and derivatives Pyrazines Vinylogous amides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Glutamic acid or derivatives - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Hippuric acid - Hippuric acid or derivatives - Pterin - Pteridine - Benzoic acid or derivatives - Benzamide - Benzoyl - Phenol ether - Phenoxy compound - Pyrimidone - Alkyl aryl ether - Aminopyrimidine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Pyrimidine - Pyrazine - Heteroaromatic compound - Vinylogous amide - Amino acid - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Ether - Azacycle - Carboxylic acid - Organooxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organic oxide - Organic oxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as glutamic acid and derivatives. These are compounds containing glutamic acid or a derivative thereof resulting from reaction of glutamic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available