Compound Identification
SMILES
CC(=O)NCC(C(N)=O)C1=CC=C(C=C1)C(=O)OC(C)(C)C
InChIKey
InChIKey=CYDMIPQEXHSPEF-UHFFFAOYSA-N
Formula
C16H22N2O4
Mass
306.362
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 Beta 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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Phenylacetamides Monocyclic monoterpenoids Benzoic acid esters Aromatic monoterpenoids Benzoyl derivatives Acetamides Secondary carboxylic acid amides Primary carboxylic acid amides Carboxylic acid esters Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Beta amino acid or derivatives - P-cymene - Aromatic monoterpenoid - Benzoate ester - Monocyclic monoterpenoid - Phenylacetamide - Monoterpenoid - Benzoic acid or derivatives - Benzoyl - Benzenoid - Monocyclic benzene moiety - Acetamide - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Primary carboxylic acid amide - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available