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44 46 1 0 0 0 0 18 20 1 0 0 0 0 36 34 1 0 0 0 0 20 22 1 0 0 0 0 46 47 1 0 0 0 0 22 24 1 0 0 0 0 41 40 1 0 0 0 0 22 23 2 0 0 0 0 47 49 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 34 33 2 0 0 0 0 18 19 1 0 0 0 0 47 48 2 0 0 0 0 9 7 1 0 0 0 0 49 54 1 0 0 0 0 7 6 1 0 0 0 0 40 39 1 0 0 0 0 5 6 1 0 0 0 0 5 4 1 0 0 0 0 33 32 1 0 0 0 0 39 58 1 0 0 0 0 32 31 2 0 0 0 0 58 44 1 0 0 0 0 49 50 1 0 0 0 0 5 59 1 0 0 0 0 4 3 1 0 0 0 0 3 61 1 0 0 0 0 61 60 1 0 0 0 0 60 59 1 0 0 0 0 54 53 1 0 0 0 0 61 62 1 0 0 0 0 53 52 1 0 0 0 0 44 45 1 6 0 0 0 52 51 1 0 0 0 0 42 43 1 0 0 0 0 51 50 1 0 0 0 0 36 37 1 0 0 0 0 31 30 1 0 0 0 0 20 21 1 0 0 0 0 54 55 1 0 0 0 0 16 17 1 0 0 0 0 7 8 1 0 0 0 0 55 56 2 0 0 0 0 13 14 1 0 0 0 0 30 29 2 0 0 0 0 3 2 1 0 0 0 0 55 57 1 0 0 0 0 39 38 1 0 0 0 0 2 1 1 0 0 0 0 57 9 1 0 0 0 0 27 28 1 0 0 0 0 42118 1 1 0 0 0 41116 1 0 0 0 0 41117 1 0 0 0 0 40114 1 0 0 0 0 40115 1 0 0 0 0 39113 1 6 0 0 0 38111 1 0 0 0 0 38112 1 0 0 0 0 36109 1 1 0 0 0 33105 1 0 0 0 0 32104 1 0 0 0 0 31103 1 0 0 0 0 30102 1 0 0 0 0 29101 1 0 0 0 0 27 97 1 1 0 0 0 26 95 1 0 0 0 0 26 96 1 0 0 0 0 35106 1 0 0 0 0 35107 1 0 0 0 0 35108 1 0 0 0 0 46123 1 0 0 0 0 46124 1 0 0 0 0 54133 1 6 0 0 0 53131 1 0 0 0 0 53132 1 0 0 0 0 52129 1 0 0 0 0 52130 1 0 0 0 0 51127 1 0 0 0 0 51128 1 0 0 0 0 50125 1 0 0 0 0 50126 1 0 0 0 0 9 76 1 1 0 0 0 10 77 1 0 0 0 0 10 78 1 0 0 0 0 15 83 1 0 0 0 0 18 87 1 6 0 0 0 20 89 1 1 0 0 0 24 91 1 1 0 0 0 25 92 1 0 0 0 0 25 93 1 0 0 0 0 25 94 1 0 0 0 0 19 88 1 0 0 0 0 7 72 1 1 0 0 0 6 70 1 0 0 0 0 6 71 1 0 0 0 0 5 69 1 6 0 0 0 4 67 1 0 0 0 0 4 68 1 0 0 0 0 3 66 1 6 0 0 0 61138 1 1 0 0 0 60136 1 0 0 0 0 60137 1 0 0 0 0 59134 1 0 0 0 0 59135 1 0 0 0 0 62139 1 0 0 0 0 45122 1 0 0 0 0 43119 1 0 0 0 0 43120 1 0 0 0 0 43121 1 0 0 0 0 37110 1 0 0 0 0 21 90 1 0 0 0 0 17 84 1 0 0 0 0 17 85 1 0 0 0 0 17 86 1 0 0 0 0 8 73 1 0 0 0 0 8 74 1 0 0 0 0 8 75 1 0 0 0 0 14 80 1 0 0 0 0 14 81 1 0 0 0 0 14 82 1 0 0 0 0 13 79 1 6 0 0 0 1 63 1 0 0 0 0 1 64 1 0 0 0 0 1 65 1 0 0 0 0 28 98 1 0 0 0 0 28 99 1 0 0 0 0 28100 1 0 0 0 0 M END > NP0027283 > NP-MRD > [H]O[C@]1([H])C([H])([H])C([H])([H])[C@@]([H])(C([H])([H])[C@@]([H])(C([H])([H])[H])[C@@]2([H])OC(=O)[C@@]3([H])N(C(=O)C([H])([H])[C@]4(O[H])O[C@@]([H])(C([H])([H])C([H])([H])[C@@]4([H])C([H])([H])[H])C([H])([H])[C@]([H])(O[H])\C(=C(\[H])/C(/[H])=C(\[H])/C(/[H])=C([H])\[C@@]([H])(C([H])([H])[H])C([H])([H])[C@]([H])(C(=O)[C@]([H])(O[H])[C@]([H])(O[H])\C(=C([H])/[C@]([H])(C(=O)C2([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C3([H])[H])C([H])([H])[C@@]1([H])OC([H])([H])[H] > InChI=1S/C49H77NO12/c1-29-14-10-9-11-15-30(2)40(52)26-37-19-17-35(7)49(59,62-37)28-44(54)50-21-13-12-16-38(50)48(58)61-42(32(4)24-36-18-20-39(51)43(25-36)60-8)27-41(53)31(3)23-34(6)46(56)47(57)45(55)33(5)22-29/h9-11,14-15,23,29,31-33,35-40,42-43,46-47,51-52,56-57,59H,12-13,16-22,24-28H2,1-8H3/b11-9+,14-10-,30-15-,34-23-/t29-,31-,32-,33-,35-,36+,37+,38+,39-,40+,42+,43-,46-,47+,49+/m1/s1 > OKJDOGTYAJCIFZ-WORREBMVSA-N > C49H77NO12 > 872.15 > 871.544576923 > 11 > 139 > 96.67606104503653 > 0 > 5 > 0 > 0 > (1S,9S,12S,15R,16Z,18R,19R,21R,23S,24Z,26E,28Z,30S,32S,35R)-1,18,19,30-tetrahydroxy-12-[(2R)-1-[(1S,3R,4R)-4-hydroxy-3-methoxycyclohexyl]propan-2-yl]-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.0^{4,9}]hexatriaconta-16,24,26,28-tetraene-3,10,14,20-tetrone > 4.28 > 5.808001448666667 > -5.00 > 0 > 4 > 0 > 12.396006193098117 > 11.542210262660946 > -1.993677943820674 > 200.35999999999999 > 240.36400000000006 > 4 > 0 > 8.81e-03 g/l > (1S,9S,12S,15R,16Z,18R,19R,21R,23S,24Z,26E,28Z,30S,32S,35R)-1,18,19,30-tetrahydroxy-12-[(2R)-1-[(1S,3R,4R)-4-hydroxy-3-methoxycyclohexyl]propan-2-yl]-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.0^{4,9}]hexatriaconta-16,24,26,28-tetraene-3,10,14,20-tetrone > 0 > NP0027283 > 15-deoxo-7,32-O-didesmethylrapamycin $$$$