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Upadacitinib Hemihydrate

Upadacitinib Hemihydrate

Product Description
CAT No.
ALN-U005001
CAS No.
2050057-56-0
Mol. F.
C17H19F3N6O : 1/2(H2O)
Mol. Wt.
380.4 : 1/2(18.0)
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Chemical Name : (3S,4R)-3-Ethyl-4-(3H-imidazo[1,2-a]pyrrolo[2,3-e]pyrazin-8-yl)-N-(2,2,2-trifluoroethyl)-1-pyrrolidinecarboxamide hemihydrate
Smiles : C(C)[C@H]1[C@@H](C=2N3C4=C(N=CC3=NC2)NC=C4)CN(C(NCC(F)(F)F)=O)C1.O
Inchi : InChI=1S/C18H34N2O6S/c1-5-6-10-7-11(20(3)8-10)17(25)19-12(9(2)21)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,21-24H,5-8H2,1-4H3,(H,19,25)/t9-,10-,11+,12-,13+,14-,15-,16-,18-/m1/s1

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