Nombre del analito

2,3,4-Tri-O-acetyl-alpha-D-glucuronide Bisphenol B Monobenzyl Ether

Fórmula molecular

C36 H40 O11

Peso molecular

648.696

Masa exacta

648.257

SMILES

CCC(C)(c1ccc(OCc2ccccc2)cc1)c3ccc(O[C@H]4O[C@H]([C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]4OC(=O)C)C(=O)OC)cc3

InChI

InChI=1S/C36H40O11/c1-7-36(5,26-13-17-28(18-14-26)42-21-25-11-9-8-10-12-25)27-15-19-29(20-16-27)46-35-33(45-24(4)39)31(44-23(3)38)30(43-22(2)37)32(47-35)34(40)41-6/h8-20,30-33,35H,7,21H2,1-6H3/t30-,31-,32-,33+,35+,36?/m1/s1

IUPAC

methyl (2R,3R,4R,5S,6R)-3,4,5-triacetyloxy-6-[4-[2-(4-phenylmethoxyphenyl)butan-2-yl]phenoxy]oxane-2-carboxylate

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat