Compound Identification
SMILES
Cl.CC(C)C[C@@H](CN)NC(=O)C1=C(NC=N1)C(=O)N[C@@H](C)C(=O)CNC[C@H](C)NC(=O)C1=C(NC=N1)C(=O)N[C@@H](CC(O)=O)C(O)=O
InChIKey
InChIKey=IPZMLXVUQSXIEY-ORGRJDPGSA-N
Formula
C27H41ClN10O9
Mass
685.14
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 Aspartic acid 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
Aspartic acid and derivatives
Alternative Parents
N-acyl-alpha amino acids 2-heteroaryl carboxamides Imidazolyl carboxylic acids and derivatives Carbonylimidazoles Dicarboxylic acids and derivatives Vinylogous amides Alpha-amino ketones Heteroaromatic compounds Amino acids Secondary carboxylic acid amides Dialkylamines Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Hydrochlorides Monoalkylamines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aspartic acid or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - 2-heteroaryl carboxamide - Imidazolyl carboxylic acid derivative - Imidazole-4-carbonyl group - Dicarboxylic acid or derivatives - Alpha-aminoketone - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Ketone - Carboxylic acid - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Secondary amine - Organic oxygen compound - Hydrochloride - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Primary aliphatic amine - Primary amine - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aspartic acid and derivatives. These are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic 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