Compound Identification
SMILES
CN(C1=CC=CC=C1)S(=O)(=O)C1=C(C)C=CC(NC(=O)N(CC2=CC=C(C=C2)C(=O)NCC(F)(F)C(O)=O)C2=CC=C(C=C2)C2CCCCC2)=C1
InChIKey
InChIKey=FGYDDPDJZCZRIK-UHFFFAOYSA-N
Formula
C38H40F2N4O6S
Mass
718.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
- Level 6 Beta 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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Sulfanilides Benzenesulfonamides N-phenylureas Benzamides Benzenesulfonyl compounds Benzoyl derivatives Toluenes Organosulfonamides Aminosulfonyl compounds Alpha-halocarboxylic acids Secondary carboxylic acid amides Ureas Monocarboxylic acids and derivatives Carboxylic acids Organofluorides Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Alkyl fluorides Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Beta amino acid or derivatives - Benzenesulfonamide - N-phenylurea - Sulfanilide - Benzamide - Benzoic acid or derivatives - Benzenesulfonyl group - Benzoyl - Toluene - Organosulfonic acid amide - Monocyclic benzene moiety - Benzenoid - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Aminosulfonyl compound - Urea - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid - Monocarboxylic acid or derivatives - Organohalogen compound - Carbonyl group - Organofluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Alkyl fluoride - Alkyl halide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available