Compound Identification
SMILES
[Na+].CCCN(CCC)C1=C(N2C(C1)C(NC(=O)CC1=CC=CC=C1)C2=O)C([O-])=O
InChIKey
InChIKey=MVZZUYGXABBALA-UHFFFAOYSA-M
Formula
C21H26N3NaO4
Mass
407.446
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
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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
N-acyl-alpha amino acids and derivatives
Alternative Parents
Carbapenems Phenylacetamides Pyrroline carboxylic acids Azepines Vinylogous amides Tertiary carboxylic acid amides Trialkylamines Secondary carboxylic acid amides Amino acids Azetidines Carboxylic acid salts Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Enamines Organic zwitterions Carbonyl compounds Hydrocarbon derivatives Organic sodium salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Carbapenem - Phenylacetamide - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Monocyclic benzene moiety - Benzenoid - Beta-lactam - Pyrroline - Tertiary carboxylic acid amide - Vinylogous amide - Tertiary aliphatic amine - Azetidine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid salt - Amino acid - Lactam - Organoheterocyclic compound - Organic alkali metal salt - Azacycle - Carboxylic acid - Enamine - Monocarboxylic acid or derivatives - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Organic oxygen compound - Organic sodium salt - Organic salt - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available