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Substance Name: 24,24-Difluoro-1,25-dihydroxyvitamin D3
RN: 72696-49-2
InChIKey: PQKFUDVFSOEHDQ-KBBGFLFPSA-N

Molecular Weight

  • 452.622
 
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Names and Synonyms

Name of Substance

  • 24,24-Difluoro-1,25-dihydroxyvitamin D3

Synonym

  • CCRIS 5802

Systematic Name

  • 24,24-Difluoro-1alpha,25-dihydroxyvitamin D3

Registry Numbers

CAS Registry Number

  • 72696-49-2

System Generated Number

  • 0072696492

Structure Descriptors

InChI

1S/C27H42F2O3/c1-17(12-14-27(28,29)25(3,4)32)22-10-11-23-19(7-6-13-26(22,23)5)8-9-20-15-21(30)16-24(31)18(20)2/h8-9,17,21-24,30-32H,2,6-7,10-16H2,1,3-5H3/b19-8+,20-9-/t17-,21+,22-,23+,24-,26-/m1/s1

InChIKey

PQKFUDVFSOEHDQ-KBBGFLFPSA-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([C@@H]1O)=C)O