分析物名称

Bisphenol E Mono-beta-D-glucuronide Sodium

分子式

C20H21O8.Na

分子量

412.37

精确质量测定

412.11

SMILES

O[C@H]1[C@H](O)[C@@H](O)[C@H](OC2=CC=C(C(C)C3=CC=C(O)C=C3)C=C2)O[C@@H]1C(O[Na])=O

InChI

InChI=1S/C20H22O8.Na/c1-10(11-2-6-13(21)7-3-11)12-4-8-14(9-5-12)27-20-17(24)15(22)16(23)18(28-20)19(25)26;/h2-10,15-18,20-24H,1H3,(H,25,26);/q;+1/p-1/t10?,15-,16-,17+,18-,20+;/m0./s1

IUPAC

sodium (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-(1-(4-hydroxyphenyl)ethyl)phenoxy)tetrahydro-2H-pyran-2-carboxylate

运输温度

Room Temperature

原产国

CANADA

产品形式

Neat