Nombre del analito

Empagliflozin 2-O-Glucuronide

Fórmula molecular

C29 H35 Cl O13

Peso molecular

627.033

Masa exacta

626.177

SMILES

OC[C@H]1O[C@H]([C@H](O[C@H]2O[C@H]([C@H](O)[C@@H](O)[C@@H]2O)C(=O)O)[C@@H](O)[C@@H]1O)c3ccc(Cl)c(Cc4ccc(O[C@H]5CCOC5)cc4)c3

InChI

InChI=1S/C29H35ClO13/c30-18-6-3-14(10-15(18)9-13-1-4-16(5-2-13)40-17-7-8-39-12-17)25-26(22(34)20(32)19(11-31)41-25)42-29-24(36)21(33)23(35)27(43-29)28(37)38/h1-6,10,17,19-27,29,31-36H,7-9,11-12H2,(H,37,38)/t17-,19+,20+,21+,22-,23+,24-,25-,26+,27+,29-/m0/s1

IUPAC

(2R,3R,4R,5S,6S)-6-[(2S,3R,4S,5S,6R)-2-[4-chloro-3-[[4-[(3S)-oxolan-3-yl]oxyphenyl]methyl]phenyl]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

Temperatura de envío

Room Temperature

País de origen

CANADA

Tipo de producto

Impurity

Formato del producto

Neat