Compound Identification
SMILES
CC(C)C(OC(=O)NC1=CC=CC=C1)C(=O)NC(CC(O)=O)C(=O)CF
InChIKey
InChIKey=VADGDBPFZAUONM-UHFFFAOYSA-N
Formula
C17H21FN2O6
Mass
368.361
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
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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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Phenylcarbamic acid esters Gamma-keto acids and derivatives N-acyl amines Carbamate esters Alpha-haloketones Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylcarbamic acid ester - Beta amino acid or derivatives - Gamma-keto acid - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Benzenoid - Keto acid - N-acyl-amine - Alpha-haloketone - Carbamic acid ester - Carboxamide group - Secondary carboxylic acid amide - Ketone - Carboxylic acid - Monocarboxylic acid or derivatives - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Alkyl fluoride - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Organohalogen 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