Posaconazole D5

Product Name Posaconazole D5
Alternate Names Posaconazole Stable Isotopes, Stable Isotopes of Posaconazole
CAT No. CS-CX-00590
CAS No. 171228-49-2(Unlabeled)
Category Stable Isotopes
Stock Enquire
Mol. Wt. 705.81 g/mol
Mol. For. C₃₇H₃₇D₅F₂N₈O₄
Hazardous This is not a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Parent API Posaconazole
Therapeutic Anti-Fungals
Smileys FC1=C(C=CC(F)=C1)[C@]2(C[C@H](COC3=C([2H])C=C(N4CCN(C5=CC([2H])=C(N(C=NN6[C@@H](CC)[C@@H](O)C)C6=O)C([2H])=C5)CC4)C=C3[2H])CO2)CN7C([2H])=NC=N7
Canonical Smiles CCC(C(C)O)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OCC5CC(OC5)(CN6C=NC=N6)C7=C(C=C(C=C7)F)F
InchIKey RAGOYPUPXAKGKH-XAKZXMRKSA-N
Inchl 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
IUPAC 4-[4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-[(2S,3S)-2-hydroxypentan-3-yl]-1,2,4-triazol-3-one
Controlled No
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Related Compounds

Posaconazole Impurity 22 | Posaconazole Diastereoisomer Related Compound 4 | rac-Posaconazole Diastereoisomer Related Compound 3 | Posaconazole Diastereoisomer Related Compound 3 | Posaconazole D4 | Posaconazole-d7 | Posaconazole D3 |

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