4-Hydroxy Duloxetine beta-D-Glucuronide
[CAS# 741693-83-4]

Identification

• Name: 4-Hydroxy Duloxetine beta-D-Glucuronide
• Synonyms: 4-[(1S)-3-(Methylamino)-1-(2-Thienyl)Propoxy]-1-Naphthalenyl B-D-Glucopyranosiduronic Acid; 4-[(1S)-3-(Methylamino)-1-(2-Thienyl)Propoxy]-1-Naphthalenyl -D-Glucopyranosiduronic Acid; 4-Hydroxy Duloxetine B-D-Glucuronide
• Molecular Formula: C₂₄H₂₇NO₈S
• Molecular Weight: 489.54
• CAS Registry Number: 741693-83-4
• SMILES: CNCC[C@@H](c1cccs1)Oc1ccc(c2c1cccc2)O[C@@H]1O[C@H](C(=O)O)[C@H]([C@@H]([C@H]1O)O)O
• InChI: 1S/C24H27NO8S/c1-25-11-10-17(18-7-4-12-34-18)31-15-8-9-16(14-6-3-2-5-13(14)15)32-24-21(28)19(26)20(27)22(33-24)23(29)30/h2-9,12,17,19-22,24-28H,10-11H2,1H3,(H,29,30)/t17-,19-,20-,21+,22-,24+/m0/