Mrv1902 03111922362D 61 64 0 0 0 0 999 V2000 3.8770 -1.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4689 -2.5434 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6381 -2.5434 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1685 -0.0364 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9896 -0.0364 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7604 0.6777 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4689 -1.1150 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 0.6777 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8721 -0.7360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1685 1.3919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2251 -1.8292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4074 0.6777 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2388 0.2696 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1894 -0.5611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9036 -0.9838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5247 -0.9692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6381 -1.1150 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9896 1.3919 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2388 -0.5562 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9530 1.4939 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0956 1.9166 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6178 0.2550 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9036 0.6680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1894 2.7183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5247 3.1313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6178 -0.5708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9036 1.4939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2388 1.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1894 1.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0462 0.2599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -3.2576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2388 2.7232 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3320 0.6680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 0.2696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6672 1.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5198 3.9571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8098 1.4939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0956 2.7328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3814 1.4988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 -3.2576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7507 -0.7506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4074 -0.7506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2382 0.6777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3992 -1.8292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 1.9070 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8098 3.1458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5240 2.7328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 -0.9644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5198 0.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4074 2.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -0.4008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -0.9838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6178 1.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6381 -3.9718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3992 -3.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 3.1409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2382 1.4939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8098 3.9718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1685 -1.4648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2285 -0.7506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -1.8097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 6 1 0 0 0 0 5 4 1 0 0 0 0 6 30 1 1 0 0 0 7 1 1 0 0 0 0 8 9 1 6 0 0 0 1 9 1 1 0 0 0 10 6 1 0 0 0 0 11 3 1 0 0 0 0 12 5 1 0 0 0 0 13 8 1 0 0 0 0 14 16 1 0 0 0 0 15 14 1 0 0 0 0 16 19 1 0 0 0 0 17 7 1 0 0 0 0 18 10 1 0 0 0 0 19 13 1 0 0 0 0 20 8 1 0 0 0 0 21 39 1 0 0 0 0 22 26 1 0 0 0 0 23 27 2 0 0 0 0 24 25 1 0 0 0 0 25 32 1 0 0 0 0 26 15 1 0 0 0 0 27 29 1 0 0 0 0 28 20 1 0 0 0 0 29 24 2 0 0 0 0 30 33 1 0 0 0 0 3 31 1 1 0 0 0 32 28 1 0 0 0 0 22 33 1 1 0 0 0 34 14 2 0 0 0 0 20 35 1 6 0 0 0 36 25 2 0 0 0 0 37 21 1 0 0 0 0 38 21 1 0 0 0 0 39 35 1 0 0 0 0 2 40 1 6 0 0 0 4 41 1 6 0 0 0 5 42 1 6 0 0 0 12 43 1 6 0 0 0 11 44 1 6 0 0 0 45 37 1 0 0 0 0 46 38 1 0 0 0 0 47 46 1 0 0 0 0 19 48 1 6 0 0 0 13 49 1 6 0 0 0 18 50 1 1 0 0 0 17 51 1 1 0 0 0 26 52 1 6 0 0 0 53 27 1 0 0 0 0 54 31 1 0 0 0 0 55 31 1 0 0 0 0 32 56 1 6 0 0 0 45 57 1 6 0 0 0 46 58 1 6 0 0 0 59 41 1 0 0 0 0 60 42 1 0 0 0 0 61 52 1 0 0 0 0 11 17 1 0 0 0 0 47 45 1 0 0 0 0 22 23 1 0 0 0 0 12 18 1 0 0 0 0 M END > DB11471 > drugbank > CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@@H](O)[C@@H]([C@H]2O)N(C)C)[C@@H](CCN2C[C@@H](C)C[C@@H](C)C2)C[C@@H](C)C(=O)\C=C\C(\C)=C\[C@@H]1CO[C@@H]1O[C@H](C)[C@@H](O)[C@@H](OC)[C@H]1OC > InChI=1S/C46H80N2O13/c1-13-36-33(24-57-46-44(56-12)43(55-11)40(53)31(8)59-46)19-25(2)14-15-34(49)28(5)20-32(16-17-48-22-26(3)18-27(4)23-48)42(29(6)35(50)21-37(51)60-36)61-45-41(54)38(47(9)10)39(52)30(7)58-45/h14-15,19,26-33,35-36,38-46,50,52-54H,13,16-18,20-24H2,1-12H3/b15-14+,25-19+/t26-,27+,28-,29+,30-,31-,32+,33-,35-,36-,38+,39-,40-,41-,42-,43-,44-,45+,46-/m1/s1 > JTSDBFGMPLKDCD-XVFHVFLVSA-N > C46H80N2O13 > 869.147 > 868.566040644 > 14 > 141 > 95.79069538239673 > 0 > 4 > 0 > 0 > (4R,5S,6S,7R,9R,11E,13E,15R,16R)-6-{[(2R,3R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy}-7-{2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]ethyl}-16-ethyl-4-hydroxy-15-({[(2R,3R,4R,5R,6R)-5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl]oxy}methyl)-5,9,13-trimethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione > 3.34 > 4.189855971000002 > -4.25 > 1 > 4 > 2 > 13.144940476945836 > 12.545816859824676 > 10.16150547462678 > 186.15 > 232.2107000000001 > 12 > 0 > 4.84e-02 g/l > (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-{[(1S,5R,13R,14S,17R)-10-hydroxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10,15-tetraen-14-yl]oxy}oxane-2-carboxylic acid > 0 > DB11471 > investigational; vet_approved > Tilmicosin > Tilmicosin > Micotil > Tilmicosin phosphate $$$$