Compound Identification
SMILES
[O-]C(=O)C(F)(F)F.C[N+]1(CC2=CC=C(F)C=C2)CCC[C@@H](C1)N([C@@H](CC1=CC=C(O)C=C1)C(N)=O)C(=O)NC1=CC=C(OS(=O)(=O)C2=C(Cl)C=C(Cl)C=C2)C=C1
InChIKey
InChIKey=VOYCIAFBNGNPCB-CKQKYKNRSA-N
Formula
C37H36Cl2F4N4O8S
Mass
843.67
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
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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 N-benzylpiperidines Benzenesulfonate esters N-phenylureas Amphetamines and derivatives Benzenesulfonyl compounds Arylsulfonic acids and derivatives Benzylamines Phenylmethylamines Phenoxy compounds Dichlorobenzenes Fluorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Aryl chlorides Aryl fluorides Fatty amides Organosulfonic acid esters Tetraalkylammonium salts Alpha-halocarboxylic acids Sulfonyls Ureas Primary carboxylic acid amides Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organofluorides Organic oxides Organic zwitterions Alkyl fluorides Organochlorides Carbonyl compounds
Molecular Framework
Not available
Substituents
Tyrosine or derivatives - Phenylalanine or derivatives - N-benzylpiperidine - Benzylpiperidine - Benzenesulfonate ester - Benzenesulfonate - Amphetamine or derivatives - N-phenylurea - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Phenoxy compound - 1,3-dichlorobenzene - Benzylamine - Phenylmethylamine - Fluorobenzene - Phenol - Aralkylamine - Chlorobenzene - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Benzenoid - Organosulfonic acid ester - Aryl halide - Fatty acyl - Aryl fluoride - Monocyclic benzene moiety - Piperidine - Aryl chloride - Fatty amide - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Tetraalkylammonium salt - Sulfonyl - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Carboxylic acid salt - Carboxamide group - Urea - Primary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic zwitterion - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Amine - Organic nitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Aromatic heteromonocyclic 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