Analyte Name

(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 2-methyl-4'-(trifluoromethoxy)-[1,1'-biphenyl]-3-carboxylate

Molecular Formula

C21H21F3O8

Molecular Weight

458.4

Accurate Mass

458.12

SMILES

O=C(C1=C(C)C(C2=CC=C(OC(F)(F)F)C=C2)=CC=C1)O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3

InChI

InChI=1S/C21H21F3O8/c1-10-13(11-5-7-12(8-6-11)32-21(22,23)24)3-2-4-14(10)19(29)31-20-18(28)17(27)16(26)15(9-25)30-20/h2-8,15-18,20,25-28H,9H2,1H3/t15-,16-,17+,18-,20+/m1/s1

IUPAC

(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 2-methyl-4'-(trifluoromethoxy)-[1,1'-biphenyl]-3-carboxylate

Alternate CAS Number

1799493-32-5

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat