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Substance Name: 24,24-Difluoro-25-hydroxyvitamin D3
RN: 71603-41-3
InChIKey: LRNVEDCUBISUTC-OWRPZGOZSA-N

Molecular Formula

  • C27-H42-F2-O2

Molecular Weight

  • 436.623
 
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Names and Synonyms

Name of Substance

  • 24,24-Difluoro-25-hydroxyvitamin D3

Synonyms

  • 24,24-Dfhv
  • 24,24-Difluoro-25-hydroxycholecalciferol

Systematic Name

  • 9,10-Secocholesta-5,7,10(19)-triene-3,25-diol, 24,24-difluoro-, (3beta,5Z,7E)-

Registry Numbers

CAS Registry Number

  • 71603-41-3

System Generated Number

  • 0071603413

Structure Descriptors

InChI

1S/C27H42F2O2/c1-18-8-11-22(30)17-21(18)10-9-20-7-6-15-26(5)23(12-13-24(20)26)19(2)14-16-27(28,29)25(3,4)31/h9-10,19,22-24,30-31H,1,6-8,11-17H2,2-5H3/b20-9+,21-10-/t19-,22-,23?,24+,26-/m1/s1

InChIKey

LRNVEDCUBISUTC-OWRPZGOZSA-N

Smiles

C1[C@H](C\C(=C\C=C2\[C@@H]3CC[C@@H]([C@@H](CCC(C(C)(C)O)(F)F)C)[C@@]3(C)CCC2)C(C1)=C)O