Nombre del analito

4-Dechloro-4-bromo Dapagliflozin (S)-(+)-1,2-Propanediol Monohydrate

Fórmula molecular

C24H33BrO8•H2O

Peso molecular

547.43

Masa exacta

546.15

SMILES

BrC1=CC=C([C@@H]2O[C@H](CO)[C@@H](O)C(O)[C@H]2O)C=C1CC3=CC=C(OCC)C=C3.OC[C@H](C)O.O

InChI

InChI=1S/C21H25BrO6.C3H8O2.H2O/c1-2-27-15-6-3-12(4-7-15)9-14-10-13(5-8-16(14)22)21-20(26)19(25)18(24)17(11-23)28-21;1-3(5)2-4;/h3-8,10,17-21,23-26H,2,9,11H2,1H3;3-5H,2H2,1H3;1H2/t17-,18-,19?,20-,21+;;/m1../s1

IUPAC

(2S,3R,5S,6R)-2-(4-bromo-3-(4-ethoxybenzyl)phenyl)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol(S)-propane-1,2-diol hydrate

Alternar número CAS

1807632-95-6

Temperatura de envío

Room Temperature

País de origen

CANADA

Tipo de producto

Bioactive Small Molecule

Formato del producto

Neat