核黄素四丁酸酯 riboflavin tetrabutyrate

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iupac名称 IUPAC Name :[(2r [(2R,3s 3S,4s)-2 4S)-2,3,4-三(丁酰氧基)-5-(7 4-tri(butanoyloxy)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)pentyl] butanoate
INCHI InChI :INCHI InChI=1/C33H44N4O10/c1-7-11-25(38)44-18-24(46-27(40)13-9-3)30(47-28(41)14-10-4)23(45-26(39)12-8-2)17-37-22-16-20(6)19(5)15-21(22)34-29-31(37)35-33(43)36-32(29)42/h15-16,23-24,30H,7-14,17-18H2,1-6H3,(H,36,42,43)/t23-,24+,30-/m0/s1
印地 Std.InChI: INCHI InChI=1S/C33H44N4O10/c1-7-11-25(38)44-18-24(46-27(40)13-9-3)30(47-28(41)14-10-4)23(45-26(39)12-8-2)17-37-22-16-20(6)19(5)15-21(22)34-29-31(37)35-33(43)36-32(29)42/h15-16,23-24,30H,7-14,17-18H2,1-6H3,(H,36,42,43)/t23-,24+,30-/m0/s1
INCHI基 InChIKey :MJNIWUJSIGSWKK-BBANNHEPBZ
标准奇奇 Std.InChIKey: MJNIWUJSIGSWKK-BBANNHEPSA-N
微笑 SMILES :cccc 抄送 CCCC(= o =O)OC[c @ h C@H]([c @ h C@H]([c @ h C@H](CN1C2=C(c = c C=C(C(=C2)C)C)N=C3C1=NC(= o =O)NC3= o =O)OC(= o =O)抄送 CCC)OC(= o =O)抄送 CCC)OC(= o =O)抄送 CCC
磨牙 Molar 折射率 Refractivity :169.66 ± 0.5 cm3 (估 est)
Parachor :1323.0 ± 8.0 cm3 (估 est)
折射率 Index of Refraction :1.584 ± 0.05 (估 est)
表面张力 Surface Tension :46.6 ± 7.0 dyne/cm (估 est)
密度 Density :1.29 ± 0.1 g/cm3 (估 est)
极化率 Polarizability :67.26 ± 0.5 10-24cm3 (估 est)