44135672 -OEChem-04192422002D 64 66 0 1 0 0 0 0 0999 V2000 8.5795 -1.4715 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 6.3415 2.7983 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 9.2605 1.7899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1728 -0.5579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3735 5.4867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3052 -4.9736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3904 3.1073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2926 2.4893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9862 -2.3850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5265 -3.6464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 4.4922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6660 -1.8782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6505 3.7494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4930 -1.0648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0325 1.8472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0206 1.5111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7584 6.6082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7664 -6.6949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7605 0.2511 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4515 1.2021 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7605 0.2511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1825 4.0855 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0696 1.2021 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2690 4.4922 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8517 4.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8052 -4.1076 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5005 1.5111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7833 -4.3155 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3517 5.6946 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8879 -5.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9743 -5.7168 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3984 -3.1940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.9922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0420 -0.3014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3545 1.8145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6957 -0.3655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3670 0.1222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7007 3.6953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5080 0.7637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 4.8299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2665 4.3679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3532 5.1930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1860 -4.0752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6229 -3.7166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8808 1.4895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4142 0.8972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9615 6.1765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0794 -5.8997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4943 -5.1811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3754 -5.8772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9678 -2.7481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8844 -3.5408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 3.5173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 3.5173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1495 2.1176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4814 1.0963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 7.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 6.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2272 -7.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1768 -6.8865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1161 -3.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.1822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1644 -1.5138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2570 3.8783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 9 1 0 0 0 0 1 12 1 0 0 0 0 1 14 2 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 13 1 0 0 0 0 2 15 2 0 0 0 0 3 20 1 0 0 0 0 3 23 1 0 0 0 0 4 19 1 0 0 0 0 5 24 1 0 0 0 0 5 29 1 0 0 0 0 6 26 1 0 0 0 0 6 31 1 0 0 0 0 7 22 1 0 0 0 0 8 27 1 0 0 0 0 9 32 1 0 0 0 0 10 28 1 0 0 0 0 10 61 1 0 0 0 0 11 33 1 0 0 0 0 11 62 1 0 0 0 0 12 63 1 0 0 0 0 13 64 1 0 0 0 0 16 23 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 29 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 18 31 1 0 0 0 0 18 59 1 0 0 0 0 18 60 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 34 1 0 0 0 0 20 27 1 0 0 0 0 20 35 1 0 0 0 0 21 23 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 33 1 0 0 0 0 24 40 1 0 0 0 0 25 29 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 28 1 0 0 0 0 26 32 1 0 0 0 0 26 43 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 30 1 0 0 0 0 28 44 1 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 M END > 44135672 > 1 > 750 > 16 > 7 > 11 > AAADceBzPAMAAAAAAAAAAAAAAAAAASJEgAAAAAAAAAAAAAAAAAAAHgAQCCAACBThgAYAAABABxAAQAAAAIAAAAAAAAAAAIAAAAEBEAIAgAAKQAAHEAADAACwMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > [5-amino-2-[[[5-amino-2-(hydroxymethyl)tetrahydrofuran-3-yl]oxy-hydroxy-phosphoryl]oxymethyl]tetrahydrofuran-3-yl] (5-amino-3-hydroxy-tetrahydrofuran-2-yl)methyl hydrogen phosphate > [5-amino-2-[[[5-amino-2-(hydroxymethyl)-3-oxolanyl]oxy-hydroxyphosphoryl]oxymethyl]-3-oxolanyl] (5-amino-3-hydroxy-2-oxolanyl)methyl hydrogen phosphate > [5-amino-2-[[[5-amino-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] (5-amino-3-hydroxyoxolan-2-yl)methyl hydrogen phosphate > [5-amino-2-[[[5-amino-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] (5-amino-3-hydroxyoxolan-2-yl)methyl hydrogen phosphate > [5-azanyl-2-[[[5-azanyl-2-(hydroxymethyl)oxolan-3-yl]oxy-oxidanyl-phosphoryl]oxymethyl]oxolan-3-yl] (5-azanyl-3-oxidanyl-oxolan-2-yl)methyl hydrogen phosphate > [5-amino-3-[(5-amino-3-hydroxy-tetrahydrofuran-2-yl)methoxy-hydroxy-phosphoryl]oxy-tetrahydrofuran-2-yl]methyl (5-amino-2-methylol-tetrahydrofuran-3-yl) hydrogen phosphate > InChI=1S/C15H31N3O13P2/c16-13-1-7(20)11(28-13)5-25-32(21,22)31-9-3-15(18)29-12(9)6-26-33(23,24)30-8-2-14(17)27-10(8)4-19/h7-15,19-20H,1-6,16-18H2,(H,21,22)(H,23,24) > AWBASQCACWFTGD-UHFFFAOYSA-N > -10.2 > 523.13321205 > C15H31N3O13P2 > 523.37 > C1C(C(OC1N)COP(=O)(O)OC2CC(OC2COP(=O)(O)OC3CC(OC3CO)N)N)O > C1C(C(OC1N)COP(=O)(O)OC2CC(OC2COP(=O)(O)OC3CC(OC3CO)N)N)O > 258 > 523.13321205 > 0 > 33 > 0 > 9 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 28 10 3 23 16 3 29 17 3 31 18 3 20 27 3 24 33 3 26 32 3 19 4 3 22 7 3 $$$$