Mrv1533004191518172D 44 43 0 0 0 0 999 V2000 4.7073 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 -6.4302 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8342 -7.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0092 -5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1362 -6.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8507 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5651 -6.0177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2796 -6.4302 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 7.8671 -7.1447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6921 -5.7158 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.9941 -6.8427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7086 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4230 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1375 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8520 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5664 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2809 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9954 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7099 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4243 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1388 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8533 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5677 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2822 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9967 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7112 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4256 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1401 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8546 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5690 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2835 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9980 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7124 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4269 -6.4302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.1414 -6.8427 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 25.7289 -7.5572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.5539 -6.1283 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 26.8559 -7.2552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.5703 -6.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.2848 -7.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.9993 -6.8427 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 29.7137 -6.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.4118 -7.5572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.5868 -6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 M CHG 4 2 1 10 -1 37 -1 41 1 M END > NP0180274 > NP-MRD > C[N+](C)(C)CCOP([O-])(=O)OCCCCCCCCCCCCCCCCCCCCCCOP([O-])(=O)OCC[N+](C)(C)C > InChI=1S/C32H70N2O8P2/c1-33(2,3)27-31-41-43(35,36)39-29-25-23-21-19-17-15-13-11-9-7-8-10-12-14-16-18-20-22-24-26-30-40-44(37,38)42-32-28-34(4,5)6/h7-32H2,1-6H3 > PUNFUIMDUBRENC-UHFFFAOYSA-N > C32H70N2O8P2 > 672.866 > 672.460741218 > 4 > 114 > 80.24760436168182 > 0 > 0 > 0 > 0 > trimethyl({2-[(22-{[2-(trimethylazaniumyl)ethyl phosphonato]oxy}docosyl phosphonato)oxy]ethyl})azanium > 1.99 > -0.4077155062768233 > -6.41 > 0 > 0 > 0 > 2.181344869882297 > 1.5792848785543345 > 117.18000000000002 > 203.214 > 33 > 0 > 3.01e-04 g/l > trimethyl({2-[(22-{[2-(trimethylammonio)ethyl phosphonato]oxy}docosyl phosphonato)oxy]ethyl})azanium > 0 > NP0180274 > trimethyl({2-[(22-{[2-(trimethylammonio)ethyl phosphonato]oxy}docosyl phosphonato)oxy]ethyl})azanium $$$$