Mrv1718006151811312D 50 54 0 0 0 0 999 V2000 -2.5094 -3.5102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1526 -1.8973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3652 -1.0340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3463 -4.7435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0577 -1.0245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3652 1.4325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0672 1.8499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2113 -0.2181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2113 0.6166 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0672 -2.6847 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0672 -3.5102 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3463 -2.2674 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7788 -2.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3463 -3.9277 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3463 -1.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3652 -2.6753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3652 -3.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5094 -2.6847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3652 -0.2087 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7788 -1.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0672 1.0340 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0672 0.1992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3463 1.0245 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3463 0.1992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0672 -3.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7788 0.6166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4998 -1.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7788 2.2674 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4903 1.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4903 1.8499 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0672 1.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7788 3.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4998 -0.2087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7788 1.0245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2113 2.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2113 0.2087 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4998 1.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4998 3.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2113 1.0245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0767 3.5007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4998 4.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9134 -0.1992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4998 2.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9134 -0.6261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7788 4.7435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2113 4.7341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0672 -4.3356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3463 -3.0832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3652 0.6166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3463 1.8499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 18 1 0 0 0 0 10 2 1 6 0 0 0 3 15 1 0 0 0 0 3 19 1 0 0 0 0 14 4 1 1 0 0 0 5 15 2 0 0 0 0 21 6 1 1 0 0 0 6 23 1 0 0 0 0 7 21 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 29 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 11 47 1 6 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 48 1 1 0 0 0 13 18 1 0 0 0 0 13 20 2 0 0 0 0 14 17 1 0 0 0 0 16 17 2 0 0 0 0 17 25 1 0 0 0 0 19 22 1 0 0 0 0 19 24 1 0 0 0 0 19 49 1 6 0 0 0 20 27 1 0 0 0 0 21 22 1 6 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 23 50 1 6 0 0 0 26 29 1 0 0 0 0 27 33 2 0 0 0 0 28 30 1 0 0 0 0 28 32 1 6 0 0 0 29 30 1 0 0 0 0 30 35 1 1 0 0 0 31 34 1 0 0 0 0 32 38 2 0 0 0 0 32 40 1 0 0 0 0 33 36 1 0 0 0 0 34 37 2 0 0 0 0 36 39 1 0 0 0 0 36 42 1 6 0 0 0 37 39 1 0 0 0 0 37 43 1 0 0 0 0 38 41 1 0 0 0 0 41 45 1 0 0 0 0 41 46 1 0 0 0 0 M END > DB11431 > drugbank > [H][C@@]12OC\C3=C/C=C/[C@H](C)C\C(C)=C\C[C@]4([H])C[C@@]([H])(C[C@]5(C\C(=N/OC)[C@H](C)[C@H](O5)C(\C)=C\C(C)C)O4)OC(=O)[C@]([H])(C=C(C)[C@H]1O)[C@@]23O > InChI=1S/C37H53NO8/c1-21(2)14-25(6)33-26(7)31(38-42-8)19-36(46-33)18-29-17-28(45-36)13-12-23(4)15-22(3)10-9-11-27-20-43-34-32(39)24(5)16-30(35(40)44-29)37(27,34)41/h9-12,14,16,21-22,26,28-30,32-34,39,41H,13,15,17-20H2,1-8H3/b10-9+,23-12+,25-14+,27-11+,38-31+/t22-,26-,28+,29-,30-,32+,33+,34+,36-,37+/m0/s1 > YZBLFMPOMVTDJY-LSGXYNIPSA-N > C37H53NO8 > 639.83 > 639.377117671 > 8 > 99 > 71.01554969651814 > 0 > 2 > 0 > 0 > (1'R,2R,4E,4'S,5S,6S,8'R,10'E,13'R,14'E,16'E,20'R,21'R,24'S)-21',24'-dihydroxy-4-(methoxyimino)-5,11',13',22'-tetramethyl-6-(4-methylpent-2-en-2-yl)-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1^{4,8}.0^{20,24}]pentacosane]-10',14',16',22'-tetraen-2'-one > 5.30 > 5.669639848666666 > -5.09 > 0 > 5 > 0 > 13.665894791674976 > 12.55355746577068 > 2.812169827467159 > 116.04000000000002 > 179.22140000000005 > 3 > 0 > 5.20e-03 g/l > (1'R,2R,4E,4'S,5S,6S,8'R,10'E,13'R,14'E,16'E,20'R,21'R,24'S)-21',24'-dihydroxy-4-(methoxyimino)-5,11',13',22'-tetramethyl-6-(4-methylpent-2-en-2-yl)-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1^{4,8}.0^{20,24}]pentacosane]-10',14',16',22'-tetraen-2'-one > 0 > DB11431 > approved; investigational; vet_approved > Moxidectin > Moxidectin; Moxidectina; Moxidectinum > Moxidectin $$$$