Analyte Name

1,6:3,4-Bis-[O-(2,3-dimethoxybutane-2,3-diyl)]-2-O-trifluoromethanesulphonyl-5-O-benzolyl-myo-inositol

CAS Number

1068089-34-8

Molecular Formula

C26H35F3O13S

Molecular Weight

644.61

Accurate Mass

644.175

SMILES

CO[C@@]1(C)O[C@@H]2[C@@H](OC(=O)c3ccccc3)C4O[C@@](C)(OC)[C@](C)(OC)O[C@H]4C(OS(=O)(=O)C(F)(F)F)[C@H]2O[C@]1(C)OC

InChI

InChI=1S/C26H35F3O13S/c1-22(33-5)24(3,35-7)40-18-16(38-22)15(37-21(30)14-12-10-9-11-13-14)17-19(20(18)42-43(31,32)26(27,28)29)41-25(4,36-8)23(2,34-6)39-17/h9-13,15-20H,1-8H3/t15-,16-,17?,18+,19-,20?,22+,23-,24+,25-/m1/s1

IUPAC

[(1R,3S,8S,10R)-5,6,12,13-tetramethoxy-5,6,12,13-tetramethyl-9-(trifluoromethylsulfonyloxy)-4,7,11,14-tetraoxatricyclo[8.4.0.03,8]tetradecan-2-yl] benzoate

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat