Compound Identification
SMILES
CC(C)OC(=O)C1=CC=C(NC(=O)N(CC2=C[N+]3=C(SC(C)=C3)N2CC2=CC=C(C=C2)C(F)(F)F)[C@@H](CC2=CC=C(O)C=C2)C(N)=O)C=C1
InChIKey
InChIKey=JNCPGRVRBLMUKR-PMERELPUSA-O
Formula
C35H35F3N5O5S
Mass
694.75
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 Tyrosine 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
Tyrosine and derivatives
Alternative Parents
Phenylalanine and derivatives Amphetamines and derivatives Trifluoromethylbenzenes Benzoic acid esters N-phenylureas Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids N-substituted imidazoles Fatty amides Heteroaromatic compounds Thiazoles Primary carboxylic acid amides Carboxylic acid esters Ureas Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tyrosine or derivatives - Phenylalanine or derivatives - Amphetamine or derivatives - N-phenylurea - Benzoate ester - Trifluoromethylbenzene - Benzoic acid or derivatives - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Fatty acyl - Benzenoid - N-substituted imidazole - Fatty amide - Heteroaromatic compound - Azole - Thiazole - Imidazole - Urea - Primary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Alkyl fluoride - Alkyl halide - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tyrosine and derivatives. These are compounds containing tyrosine or a derivative thereof resulting from reaction of tyrosine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available