(3R,3'R,4S,4'S,5S,5'S,6R,6'R)-2,2'-(5-((5-(4-Fluorophenyl)thiophen-2-yl)methyl)-4-methyl-1,3-phenylene)bis(6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol)

Analyte Name

(3R,3'R,4S,4'S,5S,5'S,6R,6'R)-2,2'-(5-((5-(4-Fluorophenyl)thiophen-2-yl)methyl)-4-methyl-1,3-phenylene)bis(6-(hydroxymethyl)-2-methoxytetrahydro-2H-pyran-3,4,5-triol)

Molecular Formula

C32 H39 F O12 S

Molecular Weight

666.708

Accurate Mass

666.215

SMILES

COC1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c2cc(Cc3ccc(s3)c4ccc(F)cc4)c(C)c(c2)C5(OC)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O

InChI

InChI=1S/C32H39FO12S/c1-15-17(11-20-8-9-24(46-20)16-4-6-19(33)7-5-16)10-18(31(42-2)29(40)27(38)25(36)22(13-34)44-31)12-21(15)32(43-3)30(41)28(39)26(37)23(14-35)45-32/h4-10,12,22-23,25-30,34-41H,11,13-14H2,1-3H3/t22-,23-,25-,26-,27+,28+,29-,30-,31?,32?/m1/s1

IUPAC

(3R,4S,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methyl-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-methoxyoxan-2-yl]phenyl]-6-(hydroxymethyl)-2-methoxyoxane-3,4,5-triol

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat