Compound Identification
SMILES
[O-]S(=O)(=O)C(F)(F)F.CN1[C@@H](CCC[NH2+]C(=O)C2=CC=C(CN=C(N)N)C=C2)C(=O)N[C@@H](CC(O)=O)C1=O
InChIKey
InChIKey=BFQASNLMLIQFPC-IODNYQNNSA-N
Formula
C20H27F3N6O8S
Mass
568.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
-
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
Alpha amino acids and derivatives
Alternative Parents
Benzoic acids and derivatives Trifluoromethanesulfonates 2,5-dioxopiperazines Benzoyl derivatives N-methylpiperazines Tertiary carboxylic acid amides Sulfonyls Quaternary ammonium salts Organosulfonic acids Methanesulfonates Trihalomethanes Secondary carboxylic acid amides Primary carboxylic acid amides Guanidines Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidamides Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Alkyl fluorides Organofluorides Organic oxides Hydrocarbon derivatives Organic zwitterions
Molecular Framework
Not available
Substituents
Alpha-amino acid or derivatives - Benzoic acid or derivatives - 2,5-dioxopiperazine - Dioxopiperazine - Benzoyl - Trifluoromethanesulfonate - N-alkylpiperazine - N-methylpiperazine - Piperazine - Benzenoid - 1,4-diazinane - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Methanesulfonate - Sulfonyl - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Alkanesulfonic acid - Trihalomethane - Carboxamide group - Guanidine - Lactam - Primary carboxylic acid amide - Secondary carboxylic acid amide - Organoheterocyclic compound - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organosulfur compound - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Halomethane - Organofluoride - Alkyl halide - Carbonyl group - Alkyl fluoride - Organic oxygen compound - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic zwitterion - Aromatic heteromonocyclic 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