CAS: 171228-50-5 - 2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[4-[4-[4-[1-[(1R,2S)-1-ethyl-2-hydroxypropyl]-1,5-dihydro-5-oxo-4H-1,2,4-triazol-4-yl]phenyl]-1-piperazinyl]phenoxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol

Formula: C₃₇H₄₂F₂N₈O₄

InChI: InChI=1S/C37H42F2N8O4/c1-3-35(26(2)48)47-36(49)46(25-42-47)31-7-5-29(6-8-31)43-14-16-44(17-15-43)30-9-11-32(12-10-30)50-20-27-19-37(51-21-27,22-45-24-40-23-41-45)33-13-4-28(38)18-34(33)39/h4-13,18,23-27,35,48H,3,14-17,19-22H2,1-2H3/t26-,27+,35+,37-/m0/s1

InChI key: InChIKey=RAGOYPUPXAKGKH-SUUNXRQISA-N

SMILES: O=C1N(N=CN1C2=CC=C(C=C2)N3CCN(C4=CC=C(OCC5COC(C6=CC=C(F)C=C6F)(CN7N=CN=C7)C5)C=C4)CC3)C(CC)C(O)C

Synonyms:

• D-threo-Pentitol, 2,5-anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[4-[4-[4-[1-[(1R,2S)-1-ethyl-2-hydroxypropyl]-1,5-dihydro-5-oxo-4H-1,2,4-triazol-4-yl]phenyl]-1-piperazinyl]phenoxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-
• 2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[4-[4-[4-[1-[(1R,2S)-1-ethyl-2-hydroxypropyl]-1,5-dihydro-5-oxo-4H-1,2,4-triazol-4-yl]phenyl]-1-piperazinyl]phenoxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol

Posaconazole Related Compound A

CAS: 171228-50-5

Nucleic acids and their salts, whether or not chemically defined; other heterocyclic compounds, nesoi

• Formula: C₃₇H₄₂F₂N₈O₄
• Color and Shape: White Powder
• Molecular weight: 700.32971

Posaconazole Diastereoisomer 6 (R,R,R,S)

CAS: 171228-50-5

• Formula: C₃₇H₄₂F₂N₈O₄
• Color and Shape: White To Off-White Solid
• Molecular weight: 700.80

Posaconazole Impurity 121

CAS: 171228-50-5

• Formula: C₆H₁₄N₂O₂
• Color and Shape: White To Off-White Solid
• Molecular weight: 146.19

Posaconazole Impurity 126

CAS: 171228-50-5

• Formula: C₃₃H₂₉F₂N₃O₂
• Color and Shape: White To Off-White Solid
• Molecular weight: 537.61

(R)-Posaconazole

CAS: 171228-50-5

• Formula: C₃₇H₄₂F₂N₈O₄
• Color and Shape: Neat
• Molecular weight: 700.777

(R)-Posaconazole

CAS: 171228-50-5

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• Formula: C₃₇H₄₂F₂N₈O₄
• Purity: Min. 95%
• Molecular weight: 700.8 g/mol