Compound Identification
SMILES
CC(C)C(C(=O)NC(CC(=O)OC(C)(C)C)C(=O)CF)C1=CC=CN(CC2=CC=CC=C2)C1=O
InChIKey
InChIKey=GBAOSYWDUKEFNH-UHFFFAOYSA-N
Formula
C26H33FN2O5
Mass
472.557
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
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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
Gamma-keto acids and derivatives Pyridinones Fatty acid esters Dihydropyridines Benzene and substituted derivatives N-acyl amines Alpha-haloketones Heteroaromatic compounds Secondary carboxylic acid amides Lactams Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - Gamma-keto acid - Dihydropyridine - Fatty acid ester - Pyridinone - Monocyclic benzene moiety - Fatty amide - Hydropyridine - Keto acid - N-acyl-amine - Pyridine - Benzenoid - Fatty acyl - Heteroaromatic compound - Alpha-haloketone - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Ketone - Lactam - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxide - Alkyl halide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organooxygen compound - Alkyl fluoride - Organonitrogen compound - Aromatic heteromonocyclic 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