Compound Identification
SMILES
CCOC(=O)C(C)(CC1CCCNC1)C1=CC=NC2=C(C=NN12)C1=CC=C(C=C1)C(F)(F)F
InChIKey
InChIKey=YAVQJGQVIKFIEQ-UHFFFAOYSA-N
Formula
C24H27F3N4O2
Mass
460.501
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
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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
Delta amino acids and derivatives
Alternative Parents
Phenylpyrazoles Trifluoromethylbenzenes Pyrazolo[1,5-a]pyrimidines Aralkylamines Fatty acid esters Pyrimidines and pyrimidine derivatives Piperidines Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Dialkylamines Azacyclic compounds Organic oxides Alkyl fluorides Carbonyl compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Delta amino acid or derivatives - Phenylpyrazole - Trifluoromethylbenzene - Pyrazolo[1,5-a]pyrimidine - Pyrazolopyrimidine - Fatty acid ester - Aralkylamine - Monocyclic benzene moiety - Piperidine - Pyrimidine - Benzenoid - Fatty acyl - Azole - Pyrazole - Heteroaromatic compound - Carboxylic acid ester - Secondary amine - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Amine - Organohalogen compound - Organofluoride - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Alkyl fluoride - Organic oxide - Alkyl halide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as delta amino acids and derivatives. These are compounds containing a carboxylic acid group and an amino group at the C5 carbon atom.
External Descriptors
Not available