Analytenname

Sulindac Sulfide Acyl-beta-D-Glucuronide

CAS-Nummer

59973-78-3

Molekularformel

C26 H25 F O8 S

Molekulargewicht

516.535

Genaue Masse

516.125

SMILES

CSc1ccc(\C=C/2\C(=C(CC(=O)OC3OC(C(O)C(O)C3O)C(=O)O)c4cc(F)ccc24)C)cc1

InChI

InChI=1S/C26H25FO8S/c1-12-17(9-13-3-6-15(36-2)7-4-13)16-8-5-14(27)10-19(16)18(12)11-20(28)34-26-23(31)21(29)22(30)24(35-26)25(32)33/h3-10,21-24,26,29-31H,11H2,1-2H3,(H,32,33)/b17-9-

IUPAC

6-[2-[(3Z)-6-fluoro-2-methyl-3-[(4-methylsulfanylphenyl)methylidene]inden-1-yl]acetyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produktformat

Neat