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Substance Name: Budesonide-beta-D-glucuronide
RN: 152129-70-9
InChIKey: FGAMTPBUXAMBFW-IBUHSXDQSA-N

Molecular Formula

  • C31-H41-F-O12

Molecular Weight

  • 624.6509
 
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Names and Synonyms

  • Budesonide-beta-D-glucuronide

Registry Numbers

CAS Registry Number

  • 152129-70-9

System Generated Number

  • 0152129709

Structure Descriptors

InChI

1S/C31H41FO12/c1-4-5-21-42-20-11-17-16-7-6-14-10-15(33)8-9-28(14,2)30(16,32)18(34)12-29(17,3)31(20,44-21)19(35)13-41-27-24(38)22(36)23(37)25(43-27)26(39)40/h8-10,16-18,20-25,27,34,36-38H,4-7,11-13H2,1-3H3,(H,39,40)/t16-,17-,18+,20+,21?,22-,23-,24+,25-,27+,28-,29-,30-,31+/m0/s1

InChIKey

FGAMTPBUXAMBFW-IBUHSXDQSA-N

Smiles

CCCC1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@@]5([C@]4([C@@H](C[C@@]3([C@@]2(O1)C(=O)CO[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O)C)O)F)C