Compound Identification
SMILES
COC(=O)C(N)CC1=C(C=C(OC2=CC=C(\C=C3\SC(=O)NC3=O)C=C2)C=C1)C(F)(F)F
InChIKey
InChIKey=TWSFIKODCFHUIP-CAOOACKPSA-N
Formula
C21H17F3N2O5S
Mass
466.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Phenylalanine and derivatives
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Level 6
Alpha 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 - Alpha amino acids and derivatives
Direct Parent
Phenylalanine and derivatives
Alternative Parents
Alpha amino acid esters Diphenylethers Diarylethers Trifluoromethylbenzenes Amphetamines and derivatives Phenoxy compounds Phenol ethers Thiazolidinediones Aralkylamines Fatty acid esters Methyl esters Dicarboximides Thiocarbamic acid derivatives Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid ester - Diphenylether - Diaryl ether - Amphetamine or derivatives - Trifluoromethylbenzene - Phenoxy compound - Phenol ether - Aralkylamine - Thiazolidinedione - Fatty acid ester - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Methyl ester - Thiazolidine - Dicarboximide - Thiocarbamic acid derivative - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Organic oxide - Organohalogen compound - Primary aliphatic amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Alkyl halide - Carbonyl group - Primary amine - Alkyl fluoride - Amine - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available