Compound Identification
SMILES
CNC1=C(OC(F)C(O)=O)C=CC(CC(NS(=O)(=O)C2=CC=CC=C2)C(=O)NCCCCC2=CC=CC=C2)=C1
InChIKey
InChIKey=WRHKZBNOUCHEME-UHFFFAOYSA-N
Formula
C28H32FN3O6S
Mass
557.64
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 Phenylalanine 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
Phenylalanine and derivatives
Alternative Parents
Alpha amino acid amides Phenylbutylamines Phenoxyacetic acid derivatives Amphetamines and derivatives Benzenesulfonamides Benzenesulfonyl compounds Aniline and substituted anilines Phenylalkylamines Phenoxy compounds Phenol ethers Secondary alkylarylamines Fatty amides Organosulfonamides Alpha-halocarboxylic acids Aminosulfonyl compounds Secondary carboxylic acid amides Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid amide - Phenoxyacetate - Phenylbutylamine - Amphetamine or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Phenoxy compound - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - Secondary aliphatic/aromatic amine - Fatty acyl - Benzenoid - Organosulfonic acid amide - Monocyclic benzene moiety - Fatty amide - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Secondary amine - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organosulfur compound - Carbonyl group - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Amine - Organopnictogen compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic homomonocyclic 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