Compound Identification
SMILES
[Na+].CC(C1=CNN=C1)C1=CN(CC(=O)N(CC([O-])=O)CC2=CC=C(C=C2)C2=CC=C(C=C2)C(F)(F)F)C(SCC2=CC=C(F)C=C2)=NC1=O
InChIKey
InChIKey=RKMZKAYYFLYERW-UHFFFAOYSA-M
Formula
C34H28F4N5NaO4S
Mass
701.67
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
N-acyl-alpha amino acids and derivatives
- Level 8 N-acyl-alpha amino acids
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Level 7
N-acyl-alpha amino acids 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 - N-acyl-alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids
Alternative Parents
Biphenyls and derivatives Trifluoromethylbenzenes Alkylarylthioethers Pyrimidones Fluorobenzenes Aryl fluorides Hydropyrimidines Vinylogous amides Tertiary carboxylic acid amides Pyrazoles Heteroaromatic compounds Carboxylic acid salts Sulfenyl compounds Azacyclic compounds Carboxylic acids Organic metal halides Monocarboxylic acids and derivatives Organonitrogen compounds Organic zwitterions Carbonyl compounds Organic sodium salts Organic oxides Hydrocarbon derivatives Alkyl fluorides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha-amino acid - Biphenyl - Trifluoromethylbenzene - Aryl thioether - Pyrimidone - Alkylarylthioether - Halobenzene - Fluorobenzene - Aryl fluoride - Pyrimidine - Aryl halide - Benzenoid - Hydropyrimidine - Monocyclic benzene moiety - Azole - Tertiary carboxylic acid amide - Vinylogous amide - Pyrazole - Heteroaromatic compound - Carboxylic acid salt - Carboxamide group - Organic metal halide - Azacycle - Organic alkali metal salt - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Sulfenyl compound - Thioether - Alkyl fluoride - Organic salt - Organic oxygen compound - Organic sodium salt - Organic nitrogen compound - Alkyl halide - Carbonyl group - Organic zwitterion - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available