Dehydroxy Bezyloxy Canagliflozin Dimer

Product Specifications

Synonyms

(2S,3R,4S,5R,6R)-3,4,5-Tris(benzyloxy)-6-((benzyloxy)methyl)-2-(3-((5-(4-fluorophenyl)thiophen-2-yl)methyl)-4-methylphenyl)-2-(((2R,3R,4R,5S,6S)-3,4,5-tris(benzyloxy)-6-(3-((5-(4-fluorophenyl)thiophen-2-yl)methyl)-4-methylphenyl)tetrahydro-2H-pyran-2-yl)methoxy)tetrahydro-2H-pyran

Hazard Statement

No Data Available

Smiles

Cc1ccc(cc1Cc2ccc(s2)c3ccc(F)cc3)[C@@H]4O[C@H](CO[C@]5(O[C@H](COCc6ccccc6)[C@@H](OCc7ccccc7)[C@H](OCc8ccccc8)[C@H]5OCc9ccccc9)c%10ccc(C)c(Cc%11ccc(s%11)c%12ccc(F)cc%12)c%10)[C@@H](OCc%13ccccc%13)[C@H](OCc%14ccccc%14)[C@H]4OCc%15ccccc%15

Molecular Formula

C97 H90 F2 O10 S2

Molecular Weight

1517.873

InChI

InChI=1S/C97H90F2O10S2/c1-67-38-40-78(54-79(67)56-84-50-52-88(110-84)76-41-46-82(98)47-42-76)90-93(103-61-72-30-16-6-17-31-72)94(104-62-73-32-18-7-19-33-73)91(101-59-70-26-12-4-13-27-70)86(108-90)66-107-97(81-45-39-68(2)80(55-81)57-85-51-53-89(111-85)77-43-48-83(99)49-44-77)96(106-64-75-36-22-9-23-37-75)95(105-63-74-34-20-8-21-35-74)92(102-60-71-28-14-5-15-29-71)87(109-97)65-100-58-69-24-10-3-11-25-69/h3-55,86-87,90-96H,56-66H2,1-2H3/t86-,87-,90+,91-,92-,93+,94+,95+,96-,97+/m1/s1

Additionnal Information

IUPAC name: (2S,3R,4S,5R,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-2-[[(2R,3R,4R,5S,6S)-6-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-3,4,5-tris(phenylmethoxy)oxan-2-yl]methoxy]-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxane