Compound Identification
SMILES
FC(F)(F)C1=CC=C(CN2CCN([C@H](C2)C(=O)NCCC2=CN=CN2CC2=CC=C(C=C2)C#N)C(=O)NC2CCCCC2)C=C1
InChIKey
InChIKey=KSHJOVNASAKXEK-SSEXGKCCSA-N
Formula
C33H38F3N7O2
Mass
621.709
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
-
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
Trifluoromethylbenzenes Piperazine carboxamides Benzonitriles Benzylamines Phenylmethylamines N-alkylpiperazines Aralkylamines N-substituted imidazoles Heteroaromatic compounds Ureas Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Nitriles Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Trifluoromethylbenzene - Piperazine-1-carboxamide - Piperazine-2-carboxamide - Benzonitrile - Benzylamine - Phenylmethylamine - N-alkylpiperazine - Aralkylamine - Benzenoid - Piperazine - N-substituted imidazole - Monocyclic benzene moiety - 1,4-diazinane - Imidazole - Heteroaromatic compound - Azole - Carboxamide group - Urea - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Amine - Alkyl halide - Organohalogen compound - Organofluoride - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - 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