Compound Identification
SMILES
COC(=O)[C@@H]1CS[C@@H]2C[C@H]([C@H](NC(=O)C(F)(F)F)C(=O)N12)C(=O)OCC1=CC=CC=C1
InChIKey
InChIKey=FBSWELHLMGFRQT-RQJABVFESA-N
Formula
C19H19F3N2O6S
Mass
460.42
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
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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
Alpha amino acid esters Benzyloxycarbonyls Piperidinecarboxylic acids Delta lactams Piperidinones Dicarboxylic acids and derivatives Thiazolidines Tertiary carboxylic acid amides Methyl esters Secondary carboxylic acid amides Azacyclic compounds Dialkylthioethers Thiohemiaminal derivatives Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Benzyloxycarbonyl - Piperidinecarboxylic acid - Delta-lactam - Piperidinone - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Piperidine - Methyl ester - Tertiary carboxylic acid amide - Thiazolidine - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Hemithioaminal - Thioether - Dialkylthioether - Azacycle - Organoheterocyclic compound - Alkyl fluoride - Organohalogen compound - Organofluoride - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Alkyl halide - Organic nitrogen compound - 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