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N-Des(D-threo-pentitol),-N-(3-pentyl)-Posaconazole, TRC
Tekniske data
Tekniske data
| Kemisk navn eller materiale | 2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[(4-[4-[4-[1-(1-ethylpropyl)-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 |
| CAS | 161532-65-6 |
| Molekylær formel | C37H42F2N8O3 |
| Mængde | 25 mg |
| Synonym | Sch 51048, Deshydroxy Posaconazole Impurity, (3R-cis)-4-[4-[4-[4-[[5-(2,4-difluorophenyl)tetrahydro-5-(1H-1,2,4-triazol-1-ylmethyl)-3-furanyl]methoxy]phenyl]-1-piperazinyl]phenyl]-2-(1-ethylpropyl)-2,4-dihydro-3H-1,2,4-Triazol-3-one |
| InChI formel | InChI=1S/C37H42F2N8O3/c1-3-29(4-2)47-36(48)46(26-42-47)32-8-6-30(7-9-32)43-15-17-44(18-16-43)31-10-12-33(13-11-31)49-21-27-20-37(50-22-27,23-45-25-40-24-41-45)34-14-5-28(38)19-35(34)39/h5-14,19,24-27,29H,3-4,15-18,20-23H2,1-2H3/t27-,37+/m1/s1 |
| SMIL | CCOCO[C@@H]1CC[C@@]2(C)[C@@](C[C@@H](OCOCC)C3C2C[C@H](OCOCC)[C@@]4(C)C3CC[C@@H]4[C@@H](CCC(OC)=O)C)([H])C1 |
| IUPAC navn | 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-pentan-3-yl-1,2,4-triazol-3-one |
| Molekylvægt (g/mol) | 684.78 |
Produkttitel
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