CAS 1373318-85-4 2'-Dihydro Boceprevir-d9 (Boceprevir Metabolite M28-d9+M31-d9 (Mixture of Diastereomers))

CAT	APS1373318854
CAS	1373318-85-4
IUPAC Name	(1R,2S,5S)-N-[(1S,2R)-3-amino-1-(cyclobutylmethyl)-2-hydroxy-3-oxo-propyl]-3-[(2S)-3,3-dimethyl-2-[[2,2,2-trideuterio-1,1-bis(trideuteriomethyl)ethyl]carbamoylamino]butanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
Molecular Weight	530.75
Molecular Formula	C27D9H38N5O5
Canonical SMILES	[2H]C([2H])([2H])C(NC(=O)N[C@H](C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@@H](CC3CCC3)[C@@H](O)C(=O)N)C2(C)C)C(C)(C)C)(C([2H])([2H])[2H])C([2H])([2H])[2H]
InChI	InChI=1S/C27H47N5O5/c1-25(2,3)20(30-24(37)31-26(4,5)6)23(36)32-13-15-17(27(15,7)8)18(32)22(35)29-16(19(33)21(28)34)12-14-10-9-11-14/h14-20,33H,9-13H2,1-8H3,(H2,28,34)(H,29,35)(H2,30,31,37)/t15-,16-,17-,18-,19+,20+/m0/s1/i4D3,5D3,6D3

Accurate Mass	530.4142
Format	Neat
Product Type	Impurity; Stable Isotope Labelled
Subcategory	HCV protease inhibitors, Enzyme inhibitors, Stable isotope labelled compounds

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CAT	Size
APS1373318854-0.25MG	0.25MG	Inquiry
APS1373318854-2.5MG	2.5MG	Inquiry