Compound Identification
SMILES
OC(=O)C(F)(F)F.NC(=N)C1=CC=C(C=C1)C1=NOC(CC(=O)NC[C@H](NS(=O)(=O)C2=CC=CC3=NSN=C23)C(O)=O)C1
InChIKey
InChIKey=HEHNYOJBQNFQAD-GPPWNDLUSA-N
Formula
C23H22F3N7O8S2
Mass
645.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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
Alpha amino acids and derivatives
Alternative Parents
Benzothiadiazoles Benzene and substituted derivatives Organosulfonamides Alpha-halocarboxylic acids Aminosulfonyl compounds Thiadiazoles Heteroaromatic compounds Isoxazolines Secondary carboxylic acid amides Azacyclic compounds Carboxylic acids Carboximidamides Carboxamidines Monocarboxylic acids and derivatives Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organic oxides Organofluorides
Molecular Framework
Not available
Substituents
Alpha-amino acid or derivatives - 2,1,3-benzothiadiazole - Organosulfonic acid amide - Benzenoid - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Azole - Alpha-halocarboxylic acid or derivatives - Isoxazoline - Aminosulfonyl compound - Thiadiazole - Sulfonyl - Alpha-halocarboxylic acid - Secondary carboxylic acid amide - Carboxamide group - Amidine - Oxacycle - Azacycle - Carboxylic acid amidine - Organoheterocyclic compound - Carboxylic acid - Carboximidamide - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available