Products 83805-11-2

CAS 83805-11-2 appears in our catalog under these names: Falecalcitriol, Falecalcitriol, 98%, 98%, Falecalcitriol, 98.72%, Falecalcitriol, 98%. Offered by: TRC, TargetMol, Chemat, MedChemExpress, Fluorochem. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 1mg, 5mg, 5 mg, 1 mg.

Falecalcitriol
TRC, TargetMol
  • size: 10mg, 25mg, 50mg, 100mg
  • Variants: 4
from 19252.96
View product
Falecalcitriol, 98%, 98%
Chemat
  • size: 1mg, 5mg
  • Variants: 2
from 2344.40
View product
Falecalcitriol, 98.72%
MedChemExpress
  • size: 5 mg, 1 mg, 50 mg, 10 mg
  • Variants: 5
from 1657.16
View product
Falecalcitriol, 98%
Fluorochem
  • size: 1mg, 5mg
  • Variants: 2
from 3902.81
View product
Structural formula: {0} (CAS {1})

Trans-(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-7,7,7-trifluoro-6-hydroxy-6-(trifluoromethyl)heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol (CAS 83805-11-2) is a chemical compound with the molecular formula C27H38F6O3 and a molecular weight of 524.6 g/mol. IUPAC name: trans-(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-7,7,7-trifluoro-6-hydroxy-6-(trifluoromethyl)heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol. InChIKey: XPYGGHVSFMUHLH-UUSULHAXSA-N.

Identity
Molecular formulaC27H38F6O3
Molecular weight524.6 g/mol
IUPAC nametrans-(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-7,7,7-trifluoro-6-hydroxy-6-(trifluoromethyl)heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
InChIKeyXPYGGHVSFMUHLH-UUSULHAXSA-N
SMILESC[C@H](CCCC(C(F)(F)F)(C(F)(F)F)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C

Computed by PubChem (NCBI)

Synonyms: falecalcitriol, Flocalcitriol, Hornel, calcitriol hexafluoride, Ro 23-4194, Falecalcitoriol, Hexafluorocalcitriol, 26,26,26,27,27,27-Hexafluoro-1,25-dihydroxyvitamin D3, F(6)-1,25(OH)2 vitamin D3, 26,27-F6-1,25-dihydroxyvitamin D3