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Substance Name: 2-Fluorovitamin D3
RN: 103638-37-5
InChIKey: BRKJGWLWZNQAQB-HUEPGBSESA-N

Note

  • Evokes calcium mobilization responses similar to those produced by vitamin D3.

Molecular Formula

  • C27-H43-F-O

Molecular Weight

  • 402.6337
 
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Names and Synonyms

Name of Substance

  • 2-Fluorovitamin D3

Systematic Name

  • 9,10-Secocholesta-5,7,10(19)-trien-3-ol, 2-fluoro-, (2alpha,3beta,5Z,7E)-

Registry Numbers

CAS Registry Number

  • 103638-37-5

System Generated Number

  • 0103638375

Structure Descriptors

InChI

1S/C27H43FO/c1-18(2)8-6-9-19(3)23-13-14-24-21(10-7-15-27(23,24)5)11-12-22-17-26(29)25(28)16-20(22)4/h11-12,18-19,23-26,29H,4,6-10,13-17H2,1-3,5H3/b21-11+,22-12-/t19-,23-,24+,25+,26+,27-/m1/s1

InChIKey

BRKJGWLWZNQAQB-HUEPGBSESA-N

Smiles

C[C@H](CCCC(C)C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@@H]([C@H](CC3=C)F)O)C