Analyte Name

Des(N-methoxycarbonyl)Velpatasvir

Molecular Formula

C47H52N8O6

Molecular Weight

824.98

Accurate Mass

824.4

SMILES

COC[C@@H]1CN(C([C@H](NC(OC)=O)C2=CC=CC=C2)=O)[C@H](C3=NC(C4=CC=C(C5=CC6=CC=C(N=C([C@@H]7CC[C@H](C)N7C([C@@H](N)C(C)C)=O)N8)C8=C6C=C5OC9)C9=C4)=CN3)C1

InChI

InChI=1S/C47H52N8O6/c1-25(2)40(48)45(56)55-26(3)11-16-37(55)44-50-35-15-13-29-19-34-32-14-12-30(18-31(32)24-61-39(34)20-33(29)42(35)52-44)36-21-49-43(51-36)38-17-27(23-59-4)22-54(38)46(57)41(53-47(58)60-5)28-9-7-6-8-10-28/h6-10,12-15,18-21,25-27,37-38,40-41H,11,16-17,22-24,48H2,1-5H3,(H,49,51)(H,50,52)(H,53,58)/t26-,27-,37-,38-,40-,41+/m0/s1

IUPAC

methyl ((R)-2-((2S,4S)-2-(4-(2-((2S,5S)-1-(L-valyl)-5-methylpyrrolidin-2-yl)-1,11-dihydroisochromeno[4',3':6,7]naphtho[1,2-d]imidazol-9-yl)-1H-imidazol-2-yl)-4-(methoxymethyl)pyrrolidin-1-yl)-2-oxo-1-phenylethyl)carbamate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat