2-AMINO-4-(1-((2R,4S,5R)-4-HYDROXY-5-(HYDROXYMETHYL)TETRAHYDROFURAN-2-YL)-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-5-YL)-7,7-DIMETHYL-5-OXO-1-PHENYL-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3-CARBONITRILE

pro_cas
pro_cdbregno
CCD03257585
pro_formula
C27 H29 N5 O6
pro_molWeight
519.555

basic_info

Product_Name: 2-AMINO-4-(1-((2R,4S,5R)-4-HYDROXY-5-(HYDROXYMETHYL)TETRAHYDROFURAN-2-YL)-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-5-YL)-7,7-DIMETHYL-5-OXO-1-PHENYL-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3-CARBONITRILE
EnglishSynonyms: 2-AMINO-4-(1-((2R,4S,5R)-4-HYDROXY-5-(HYDROXYMETHYL)TETRAHYDROFURAN-2-YL)-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN-5-YL)-7,7-DIMETHYL-5-OXO-1-PHENYL-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3-CARBONITRILE
pro_mdlNumber: MFCD16877583
pro_acceptors: 11
pro_donors: 4
pro_smile: CC1(CC2=C(C(C(=C(N2c3ccccc3)N)C#N)c4cn(c(=O)[nH]c4=O)[C@H]5C[C@@H]([C@H](O5)CO)O)C(=O)C1)C
InChi: InChI=1S/C27H29N5O6/c1-27(2)9-17-23(19(35)10-27)22(15(11-28)24(29)32(17)14-6-4-3-5-7-14)16-12-31(26(37)30-25(16)36)21-8-18(34)20(13-33)38-21/h3-7,12,18,20-22,33-34H,8-10,13,29H2,1-2H3,(H,30,36,37)/t18-,20+,21+,22?/m0/s1
InChiKey: InChIKey=NIXIXMKVERXVLN-JKCSXKQMSA-N

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