Compound Identification
SMILES
CC(C)[C@@H](NC(=O)[C@H](C(C)C)N(CC1=CC=CC=C1)C([O-])=O)[C@@H](O)C(F)(F)F
InChIKey
InChIKey=MFLTZIOUGJILTO-OWCLPIDISA-M
Formula
C19H26F3N2O4
Mass
403.423
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 Valine and derivatives
-
Level 6
Alpha 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 - Alpha amino acids and derivatives
Direct Parent
Valine and derivatives
Alternative Parents
N-acyl amines Benzene and substituted derivatives Tertiary amines Secondary carboxylic acid amides Secondary alcohols Fluorohydrins Carbamic acids Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organic anions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Valine or derivatives - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Fatty amide - N-acyl-amine - Carbamic acid - Carbamic acid derivative - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Fluorohydrin - Halohydrin - Alcohol - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Organic anion - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available