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Substance Name: Milnacipran carbamoyl o-glucuronide, D-
RN: 1446438-97-6
UNII: 9TK9IO76V9
InChIKey: CJQUAXXSVBPRHH-BHNQXGFYSA-N

Molecular Formula

  • C22-H30-N2-O9

Molecular Weight

  • 466.484
 
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Names and Synonyms

Name of Substance

  • Milnacipran carbamoyl o-glucuronide, D-

Synonyms

  • beta-D-Glucopyranuronic acid, 1-(N-(((1S,2R)-2-((diethylamino)carbonyl)-2-phenylcyclopropyl)methyl)carbamate)
  • Dextromilnacipran carbamoyl o-glucuronide
  • Milnacipran carbamoyl o-glucuronide, D-
  • UNII-9TK9IO76V9

Registry Numbers

CAS Registry Number

  • 1446438-97-6

FDA UNII

  • 9TK9IO76V9

System Generated Number

  • 1446438976

Structure Descriptors

InChI

1S/C22H30N2O9/c1-3-24(4-2)20(30)22(12-8-6-5-7-9-12)10-13(22)11-23-21(31)33-19-16(27)14(25)15(26)17(32-19)18(28)29/h5-9,13-17,19,25-27H,3-4,10-11H2,1-2H3,(H,23,31)(H,28,29)/t13-,14+,15+,16-,17+,19+,22+/m1/s1

InChIKey

CJQUAXXSVBPRHH-BHNQXGFYSA-N

Smiles

CCN(CC)C(=O)[C@@]1(C[C@@H]1CNC(=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)c3ccccc3