Analytenname

Bisphenol G Mono-beta-D-Glucuronide Sodium

Molekularformel

C27H35NaO8

Molekulargewicht

510.55

Genaue Masse

510.23

SMILES

O[C@H]1[C@H](O)[C@@H](O)[C@H](OC(C(C(C)C)=C2)=CC=C2C(C)(C)C3=CC(C(C)C)=C(O)C=C3)O[C@@H]1C(O[Na])=O

InChI

InChI=1S/C27H36O8.Na/c1-13(2)17-11-15(7-9-19(17)28)27(5,6)16-8-10-20(18(12-16)14(3)4)34-26-23(31)21(29)22(30)24(35-26)25(32)33;/h7-14,21-24,26,28-31H,1-6H3,(H,32,33);/q;+1/p-1/t21-,22-,23+,24-,26+;/m0./s1

IUPAC

[(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[1-(4-hydroxy-3-isopropyl-phenyl)-1-methyl-ethyl]-2-isopropyl-phenoxy]tetrahydropyran-2-carbonyl]oxysodium

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produktformat

Neat