Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1CC(N2NC(=CC2=N1)C(=O)NC1=CC2=C(CCC2)C=C1)C(F)(F)F
InChIKey
InChIKey=STXPGHDORFHAGT-UHFFFAOYSA-N
Formula
C25H25F3N4O3
Mass
486.495
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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 Pyrimidinecarboxamides Pyrazolopyrimidines Indanes Phenoxy compounds Anisoles N-arylamides Alkyl aryl ethers Imidolactams Hydropyrimidines Pyrazolines Pyrazoles Secondary carboxylic acid amides Amidrazones Propargyl-type 1,3-dipolar organic compounds Amidines Azacyclic compounds Organic oxides Organofluorides Alkyl fluorides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - O-dimethoxybenzene - Dimethoxybenzene - Pyrimidinecarboxamide - Pyrazolopyrimidine - Indane - Phenoxy compound - Anisole - Methoxybenzene - N-arylamide - Phenol ether - Alkyl aryl ether - Imidolactam - Benzenoid - 1,4,5,6-tetrahydropyrimidine - Hydropyrimidine - Pyrimidine - Monocyclic benzene moiety - Pyrazole - Pyrazoline - Secondary carboxylic acid amide - Carboxylic acid amidrazone - Carboxamide group - Propargyl-type 1,3-dipolar organic compound - Amidine - Ether - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organooxygen compound - Alkyl halide - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen 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