Compound Identification
SMILES
COC(=O)C1=C(CN2[C@@H]3CC(F)(F)[C@@H]2C[C@@H](CC(O)=O)C3)NC(=N[C@H]1C1=C(C)C(F)=C(F)C=C1)C1=NC=CS1
InChIKey
InChIKey=IHBAHDYOBROGMP-VKLAREITSA-N
Formula
C26H26F4N4O4S
Mass
566.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Tropane alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Tropane alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tropane alkaloids
Alternative Parents
Fluorobenzenes Toluenes Dicarboxylic acids and derivatives Hydropyrimidines Imidolactams N-alkylpyrrolidines Aryl fluorides Piperidines Methyl esters Heteroaromatic compounds Vinylogous amides Enoate esters Thiazoles Amino acids Trialkylamines Carboxamidines Carboxylic acids Carboximidamides Azacyclic compounds Enamines Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tropane alkaloid - Fluorobenzene - Halobenzene - Toluene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Hydropyrimidine - Piperidine - N-alkylpyrrolidine - Benzenoid - Imidolactam - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Heteroaromatic compound - Methyl ester - Vinylogous amide - Azole - Thiazole - Pyrrolidine - Amino acid - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboximidamide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Carboxylic acid - Enamine - Hydrocarbon derivative - Alkyl fluoride - Carbonyl group - Alkyl halide - Amine - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tropane alkaloids. These are organic compounds containing the nitrogenous bicyclic alkaloid parent N-Methyl-8-azabicyclo[3.2.1]octane.
External Descriptors
Not available