Compound Identification
SMILES
CNC[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO.CC1=C(C=CC=C1NC1=C(C=CC=N1)C(O)=O)C(F)(F)F
InChIKey
InChIKey=MGCCHNLNRBULBU-UHMOUUBWSA-N
Formula
C21H28F3N3O7
Mass
491.464
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Monosaccharides
- Level 6 Hexoses
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Level 5
Monosaccharides
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Monosaccharides
Direct Parent
Hexoses
Alternative Parents
Trifluoromethylbenzenes Pyridinecarboxylic acids Aniline and substituted anilines Aminopyridines and derivatives Toluenes Imidolactams Heteroaromatic compounds Vinylogous amides 1,3-aminoalcohols 1,2-aminoalcohols Secondary alcohols Polyols Dialkylamines Carboxylic acids Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Primary alcohols
Molecular Framework
Not available
Substituents
Hexose monosaccharide - Trifluoromethylbenzene - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Aniline or substituted anilines - Aminopyridine - Toluene - Monocyclic benzene moiety - Pyridine - Benzenoid - Imidolactam - 1,3-aminoalcohol - Heteroaromatic compound - Vinylogous amide - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Secondary amine - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organic nitrogen compound - Amine - Alkyl halide - Alcohol - Alkyl fluoride - Primary alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as hexoses. These are monosaccharides in which the sugar unit is a is a six-carbon containing moeity.
External Descriptors
Not available