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Substance Name: Pefcalcitol [USAN:INN]
RN: 381212-03-9
UNII: KT5224XSHW
InChIKey: SVCSMAZYWOQCBW-NVJMFHFGSA-N

Molecular Weight

  • 519.5476
 
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Names and Synonyms

Name of Substance

  • Pefcalcitol [USAN:INN]

Synonyms

  • 2-(((1S,3R,5z,7E,20S)-1,3-dihydroxy-9,10-secopregna-5,7,10(19),16-tetraen-20-yl)oxy)-N-(2,2,3,3,3-pentafluoropropyl)acetamide
  • Acetamide, 2-((1S)-1-((3aS,7E,7as)-7-((2Z)-((3S,5R)-3,5-dihydroxy-2-methylenecyclohexylidene)ethylidene)-3a,4,5,6,7,7a-hexahydro-3a-methyl-1H-inden-3-yl)ethoxy)-N-(2,2,3,3,3-pentafluoropropyl)-
  • M 518101
  • M518101
  • Pefcalcitol
  • UNII-KT5224XSHW

Registry Numbers

CAS Registry Number

  • 381212-03-9

FDA UNII

  • KT5224XSHW

System Generated Number

  • 0381212039

Structure Descriptors

InChI

1S/C26H34F5NO4/c1-15-18(11-19(33)12-22(15)34)7-6-17-5-4-10-24(3)20(8-9-21(17)24)16(2)36-13-23(35)32-14-25(27,28)26(29,30)31/h6-8,16,19,21-22,33-34H,1,4-5,9-14H2,2-3H3,(H,32,35)/b17-6+,18-7-/t16-,19+,21-,22-,24+/m0/s1

InChIKey

SVCSMAZYWOQCBW-NVJMFHFGSA-N

Smiles

C[C@@H](C1=CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C)OCC(=O)NCC(C(F)(F)F)(F)F