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Substance Name: 25-Hydroxyvitamin D2-25-glucuronide
RN: 76020-77-4
InChIKey: MWEHQOJAQKGFMP-JJVXHKTJSA-N

Note

  • Biliary metabolite of vitamin D2 in chick.

Molecular Weight

  • 588.777
 
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Names and Synonyms

Name of Substance

  • 25-Hydroxyvitamin D2-25-glucuronide

Synonyms

  • 25-Hvd2-25-gur
  • 25-Hydroxyergocalciferol-25-glucuronide

Systematic Name

  • beta-D-Glucopyranosiduronic acid, (3beta,5Z,7E,22E)-3-hydroxy-9,10-secoergosta-5,7,10(19),22-tetraen-25-yl

Registry Numbers

CAS Registry Number

  • 76020-77-4

System Generated Number

  • 0076020774

Structure Descriptors

InChI

1S/C34H52O8/c1-19-10-14-24(35)18-23(19)13-12-22-8-7-17-34(6)25(15-16-26(22)34)20(2)9-11-21(3)33(4,5)42-32-29(38)27(36)28(37)30(41-32)31(39)40/h9,11-13,20-21,24-30,32,35-38H,1,7-8,10,14-18H2,2-6H3,(H,39,40)/b11-9+,22-12+,23-13-/t20-,21+,24?,25-,26?,27+,28+,29-,30+,32+,34-/m1/s1

InChIKey

MWEHQOJAQKGFMP-JJVXHKTJSA-N

Smiles

O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)C(=O)O)C([C@H](\C=C\[C@H]([C@H]1CC[C@@H]2\C(=C\C=C3\C[C@@H](CCC3=C)O)CCC[C@@]12C)C)C)(C)C