67375220 -OEChem-04192400532D 70 74 0 1 0 0 0 0 0999 V2000 4.5542 12.0326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 2.7181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2867 9.7767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2867 0.4621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2729 10.8460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2729 1.5314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8072 16.2074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8072 6.8928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2982 13.2968 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2982 3.9822 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3062 14.9062 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3062 5.5917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5686 12.9867 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5686 3.6721 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1654 14.1172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1654 4.8026 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6041 12.3447 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6041 3.0302 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5988 10.7267 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5988 1.4121 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0137 11.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0137 2.2231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5509 11.0326 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5509 1.7181 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3580 10.4422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3580 1.1276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3535 13.6062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3535 4.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3585 14.6062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3585 5.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8858 14.0986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8858 4.7840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5798 15.2336 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5798 5.9190 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6038 15.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6038 5.7014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5948 13.2140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5948 3.8995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 12.7817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 3.4672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9862 10.6317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0358 0.9723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5543 11.9540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5516 11.1243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5543 2.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5516 1.8097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1043 11.3123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 1.9977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9106 10.0130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 9.9271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9106 0.6984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 0.6125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5058 14.0955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5058 4.7810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7001 9.3146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7001 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 15.4355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1436 6.3596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7035 12.3815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7035 3.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6069 15.6359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 15.1569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6069 6.3214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.8424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7733 10.4799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7733 1.1654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2058 12.7312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2058 3.4167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3548 16.6314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3548 7.3168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 23 1 0 0 0 0 2 18 1 0 0 0 0 2 24 1 0 0 0 0 19 3 1 1 0 0 0 3 55 1 0 0 0 0 20 4 1 1 0 0 0 4 56 1 0 0 0 0 5 25 1 0 0 0 0 5 65 1 0 0 0 0 6 26 1 0 0 0 0 6 66 1 0 0 0 0 33 7 1 1 0 0 0 7 69 1 0 0 0 0 34 8 1 1 0 0 0 8 70 1 0 0 0 0 17 9 1 6 0 0 0 9 27 1 0 0 0 0 9 31 1 0 0 0 0 18 10 1 6 0 0 0 10 28 1 0 0 0 0 10 32 1 0 0 0 0 11 29 1 0 0 0 0 11 31 2 0 0 0 0 12 30 1 0 0 0 0 12 32 2 0 0 0 0 13 27 1 0 0 0 0 13 37 1 0 0 0 0 13 59 1 0 0 0 0 14 28 1 0 0 0 0 14 38 1 0 0 0 0 14 60 1 0 0 0 0 15 35 1 0 0 0 0 15 37 2 0 0 0 0 16 36 1 0 0 0 0 16 38 2 0 0 0 0 17 21 1 0 0 0 0 17 39 1 0 0 0 0 18 22 1 0 0 0 0 18 40 1 0 0 0 0 19 21 1 0 0 0 0 19 23 1 0 0 0 0 19 41 1 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 25 1 6 0 0 0 23 47 1 0 0 0 0 24 26 1 6 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 29 2 0 0 0 0 28 30 2 0 0 0 0 29 33 1 0 0 0 0 30 34 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 33 35 1 0 0 0 0 33 57 1 0 0 0 0 34 36 1 0 0 0 0 34 58 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 37 67 1 0 0 0 0 38 68 1 0 0 0 0 M END > 67375220 > 1 > 356 > 12 > 8 > 4 > AAADcfB7/AAAAAAAAAAAAAAAAAAAAWLEiQAAAAAABAgAAACB4AAAHgAQCAAACBzhlgYFsBfMFgCgAQZhZAQAgC0xEKABUIA4WAiDfAJAyAEeQAAPAALTUCCwMAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (8R)-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol > (8R)-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol > (8R)-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol > (8R)-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol > (8R)-3-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol > (8R)-3-[(2R,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol > InChI=1S/2C11H16N4O4/c2*16-3-8-6(17)1-9(19-8)15-5-14-10-7(18)2-12-4-13-11(10)15/h2*4-9,16-18H,1-3H2,(H,12,13)/t2*6-,7+,8+,9+/m00/s1 > RMYDVQYPESNSLX-TYIXXHQUSA-N > 536.23431001 > C22H32N8O8 > 536.5 > C1C(C(OC1N2C=NC3=C2NC=NCC3O)CO)O.C1C(C(OC1N2C=NC3=C2NC=NCC3O)CO)O > C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC=NC[C@H]3O)CO)O.C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC=NC[C@H]3O)CO)O > 224 > 536.23431001 > 0 > 38 > 8 > 0 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 18 10 6 10 28 8 10 32 8 11 29 8 11 31 8 12 30 8 12 32 8 23 25 6 24 26 6 27 29 8 28 30 8 19 3 5 20 4 5 33 7 5 34 8 5 17 9 6 9 27 8 9 31 8 $$$$