Compound Identification
SMILES
CC(C)(C)OC(=O)C1=C(C[C@@H]2[C@@H](NC(=O)CC3=CC=CC=C3)C(=O)N12)C1=CC=CC=C1
InChIKey
InChIKey=WKKQMLRWTIXOMA-TZIWHRDSSA-N
Formula
C25H26N2O4
Mass
418.493
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
-
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
Cinnamic acid esters Phenylpyrrolines Carbapenems Phenylacetamides Pyrroline carboxylic acids Azepines Tertiary carboxylic acid amides Pyrroles Enoate esters Secondary carboxylic acid amides Azetidines Azacyclic compounds Monocarboxylic acids and derivatives Organonitrogen compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Cinnamic acid or derivatives - Cinnamic acid ester - Carbapenem - 3-phenylpyrroline - Phenylacetamide - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Monocyclic benzene moiety - Benzenoid - Beta-lactam - Pyrrole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrroline - Tertiary carboxylic acid amide - Lactam - Carboxylic acid ester - Carboxamide group - Azetidine - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic oxide - 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