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Substance Name: 1,25-Dihydroxyvitamin D3 monoglucuronide
RN: 82694-73-3
InChIKey: CGODHANLPLSWJC-CFOWCDJJSA-N

Note

  • Found in rat bile.

Molecular Weight

  • 592.7648
 
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Names and Synonyms

Name of Substance

  • 1,25-Dihydroxyvitamin D3 monoglucuronide

Synonym

  • 1,25-Dvdmg

Systematic Name

  • beta-D-Glucopyranosiduronic acid, (1alpha,3beta,5Z,7E)-dihydroxy-9,10-secocholesta-5,7,10(19)-trienyl

Registry Numbers

CAS Registry Number

  • 82694-73-3

System Generated Number

  • 0082694733

Structure Descriptors

InChI

1S/C33H52O9/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-32(25,26)5)12-13-23-18-24(14-11-20(23)3)40-33(38)30(36)28(35)27(34)29(41-33)31(37)42-39/h12-13,19,21,24-30,34-36,38-39H,3,6-11,14-18H2,1-2,4-5H3/b22-12+,23-13+/t21-,24?,25?,26?,27+,28+,29+,30-,32-,33-/m1/s1

InChIKey

CGODHANLPLSWJC-CFOWCDJJSA-N

Smiles

C[C@H](CCCC(C)C)C1CCC\2[C@@]1(CCC/C2=C\C=C\3/CC(CCC3=C)O[C@@]4([C@@H]([C@H]([C@@H]([C@H](O4)C(=O)OO)O)O)O)O)C