Compound Identification
SMILES
CC(C)(C)[C@@H]1CCC2=C(C1)SC(NC(=O)C1=CC3=N[C@H](C[C@@H](N3N1)C(F)(F)F)C1=CC=CO1)=C2C(N)=O
InChIKey
InChIKey=PAKFEMOELGRXGT-RVZJWNSFSA-N
Formula
C25H28F3N5O3S
Mass
535.59
Taxonomic Classification
Taxonomy Tree
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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
Pyrimidinecarboxamides Pyrazolopyrimidines Thiophene carboxamides N-arylamides Hydropyrimidines Imidolactams Furans Heteroaromatic compounds Vinylogous amides Pyrazolines Pyrazoles Secondary carboxylic acid amides Amidrazones Primary carboxylic acid amides Azacyclic compounds Amidines Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Organopnictogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Pyrazolopyrimidine - Pyrimidinecarboxamide - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - N-arylamide - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyrimidine - Imidolactam - Vinylogous amide - Furan - Pyrazole - Heteroaromatic compound - Thiophene - Pyrazoline - Carboxylic acid amidrazone - Carboxamide group - Primary carboxylic acid amide - Secondary carboxylic acid amide - Amidine - Oxacycle - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Organic oxide - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organic oxygen 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