Compound Identification
SMILES
COC1=CC=C(NC(=O)C2=CC3=NC(CC(N3N2)C(F)(F)F)C2=CC(OC)=C(OC)C=C2)C=C1
InChIKey
InChIKey=DVNHOLRMPNAEEX-UHFFFAOYSA-N
Formula
C23H23F3N4O4
Mass
476.456
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
Dimethoxybenzenes Anilides Pyrimidinecarboxamides Pyrazolopyrimidines Methoxyanilines Anisoles N-arylamides Phenoxy compounds Alkyl aryl ethers Imidolactams Hydropyrimidines Pyrazoles Pyrazolines Secondary carboxylic acid amides Amidrazones Azacyclic compounds Amidines Propargyl-type 1,3-dipolar organic compounds Organic oxides Alkyl fluorides Hydrocarbon derivatives Carbonyl compounds Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Dimethoxybenzene - O-dimethoxybenzene - Pyrazolopyrimidine - Pyrimidinecarboxamide - Anilide - Methoxyaniline - Methoxybenzene - Phenoxy compound - Anisole - Phenol ether - N-arylamide - Alkyl aryl ether - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyrimidine - Imidolactam - Benzenoid - Pyrazoline - Pyrazole - Carboxylic acid amidrazone - Secondary carboxylic acid amide - Carboxamide group - Organic 1,3-dipolar compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Amidine - Azacycle - Ether - Alkyl fluoride - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl halide - 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