3-(beta-D-glucopyranosyloxy)-5-methyl-4-[(4-methylthiophenyl)methyl]-1H-pyrazole

HCID 9952610

Substructure search Find similar structures

Basic information

Standard SMILES: CSc1ccc(Cc2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)n[nH]c2C)cc1
InChIKey: YDUBQUANDNHHKO-QFXBJFAPSA-N
Molecular formula: C18H24N2O6S
Average molar mass: 396.5 g/mol
Monoisotopic mass: 396.13550766

Names & identifiers

Preferred name: 3-(beta-D-glucopyranosyloxy)-5-methyl-4-[(4-methylthiophenyl)methyl]-1H-pyrazole
IUPAC: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[5-methyl-4-[(4-methylsulfanylphenyl)methyl]-1H-pyrazol-3-yl]oxy]oxane-3,4,5-triol

Names & synonyms

CHEMBL3908950SCHEMBL2252428YDUBQUANDNHHKO-QFXBJFAPSA-NBDBM505595383- (beta-D-glucopyranosyloxy) -5-methyl-4-[(4-methylthiophenyl)methyl]-1H-pyrazole3-(beta-D-glucopyranosyloxy)-5-methyl-4-[(4-methylthiophenyl)methyl]-1H-pyrazole