丹诺普韦钠盐 ,916826-48-7 _ChemCD

丹诺普韦钠盐

basic_info
Product_Name：	丹诺普韦钠盐
CAS：	916826-48-7
中文同义词：	丹诺普韦钠盐
EnglishSynonyms：	DANOPREVIR (NA) ; 4-FLUORO-1,3-DIHYDRO-2H-ISOINDOLE-2-CARBOXYLIC ACID (2R,6S,12Z,13AS,14AR,16AS)-14A-[[(CYCLOPROPYLSULFONYL)AMINO]CARBONYL]-6-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-1,2,3,5,6,7,8,9,10,11,13A,14,14A,15,16,16A-HEXADECAHYDRO-5,16-DIOXOCYCLOPROPA[E]PYRROLO[1,2-A][1,4]DIAZACYCLOPENTADECIN-2-YL ESTER SODIUM SALT ; DANOPREVIR SODIUM SALT
pro_mdlNumber：	MFCD21608528
pro_acceptors：	14
pro_donors：	2
pro_smile：	CC(C)(C)OC(=O)N[C@H]1CCCCC/C=C\[C@@H]2C[C@]2(NC(=O)[C@@H]3C[C@H](CN3C1=O)OC(=O)N4Cc5cccc(c5C4)F)C(=O)N([Na])S(=O)(=O)C6CC6
InChi：	InChI=1S/C35H46FN5O9S.Na/c1-34(2,3)50-32(45)37-27-13-8-6-4-5-7-11-22-17-35(22,31(44)39-51(47,48)24-14-15-24)38-29(42)28-16-23(19-41(28)30(27)43)49-33(46)40-18-21-10-9-12-26(36)25(21)20-40;/h7,9-12,22-24,27-28H,4-6,8,13-20H2,1-3H3,(H3,37,38,39,42,44,45);/q;+1/p-1/b11-7-;/t22-,23-,27+,28+,35-;/m1./s1
InChiKey：	InChIKey=GXYYUDQAGCVAGJ-HHGSPMIASA-M

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