Mrv1572001261617322D 71 77 0 0 1 0 999 V2000 5.0301 -2.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8610 -2.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3707 2.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9976 4.2035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5775 -5.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7372 -2.9611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4467 -0.5575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5599 0.2597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6824 -0.8681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2564 -0.3949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9075 -0.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9087 0.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0313 -0.3615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3695 0.4223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3230 -1.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0873 -0.7868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9553 2.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1910 1.9754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 2.9432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5492 0.5370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 -2.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4267 1.6648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8955 0.8697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7944 -1.7187 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2098 -1.9146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6064 1.7795 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9705 3.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6907 -4.4809 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1444 0.4557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7184 0.9289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2004 0.0304 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6624 1.3542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5958 2.0567 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1527 -3.1571 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5681 -3.3531 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2429 2.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0395 -3.9743 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4455 -2.2252 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4933 0.9623 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2158 2.1656 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2469 1.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0778 1.1582 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8315 1.7461 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5423 3.4259 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2752 -4.2849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1338 0.7330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9188 2.5665 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8147 3.0371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5015 -2.6505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5849 1.6340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4550 -4.1703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0112 1.8608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3324 -3.0425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9647 0.3410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7290 0.6516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4921 -0.7055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6718 -0.5908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4827 1.2395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5587 -1.4080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1432 -1.2121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2576 1.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9264 -4.7915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8515 -0.4762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7755 2.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3516 2.3875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3884 -3.4677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2193 -3.8597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8038 -3.6637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6812 -2.5359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3801 0.1451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4735 2.5257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8 7 1 0 0 0 0 9 7 1 0 0 0 0 11 10 2 0 0 0 0 12 8 1 0 0 0 0 13 9 1 0 0 0 0 14 10 1 0 0 0 0 16 15 1 0 0 0 0 18 17 1 0 0 0 0 24 1 1 1 0 0 0 24 11 1 0 0 0 0 25 2 1 0 0 0 0 25 15 2 0 0 0 0 26 3 1 6 0 0 0 26 17 1 0 0 0 0 27 4 1 0 0 0 0 27 19 2 0 0 0 0 28 5 1 1 0 0 0 29 12 1 0 0 0 0 29 13 1 0 0 0 0 30 14 2 0 0 0 0 30 23 1 0 0 0 0 31 16 1 0 0 0 0 31 20 1 0 0 0 0 32 20 1 0 0 0 0 32 22 1 0 0 0 0 33 19 1 0 0 0 0 34 21 1 0 0 0 0 35 21 1 0 0 0 0 36 27 1 0 0 0 0 37 28 1 0 0 0 0 37 34 1 0 0 0 0 38 24 1 0 0 0 0 38 25 1 0 0 0 0 39 26 1 0 0 0 0 39 29 1 1 0 0 0 40 36 1 0 0 0 0 41 33 1 0 0 0 0 42 18 1 0 0 0 0 42 22 1 0 0 0 0 43 30 1 0 0 0 0 43 33 1 0 0 0 0 43 40 1 0 0 0 0 44 36 2 0 0 0 0 37 45 1 1 0 0 0 46 41 2 0 0 0 0 43 47 1 1 0 0 0 48 44 1 0 0 0 0 49 6 1 0 0 0 0 34 49 1 1 0 0 0 50 23 1 0 0 0 0 50 40 1 0 0 0 0 51 28 1 0 0 0 0 51 35 1 0 0 0 0 52 32 1 0 0 0 0 52 41 1 0 0 0 0 35 53 1 6 0 0 0 38 53 1 1 0 0 0 54 31 1 0 0 0 0 42 54 1 6 0 0 0 55 39 1 0 0 0 0 55 42 1 0 0 0 0 56 10 1 0 0 0 0 57 11 1 0 0 0 0 58 14 1 0 0 0 0 59 15 1 0 0 0 0 24 60 1 6 0 0 0 26 61 1 1 0 0 0 28 62 1 6 0 0 0 31 63 1 1 0 0 0 32 64 1 1 0 0 0 33 65 1 6 0 0 0 34 66 1 6 0 0 0 35 67 1 1 0 0 0 37 68 1 1 0 0 0 38 69 1 6 0 0 0 39 70 1 6 0 0 0 40 71 1 1 0 0 0 M END > CHEM018633 > chemdb > [H]\C1=C(C)/[C@@]([H])(O[C@@]2([H])C[C@]([H])(OC)[C@@]([H])(O)[C@]([H])(C)O2)[C@@]([H])(C)\C([H])=C(/[H])\C(\[H])=C2/CO[C@]3([H])\C(=N/O)C(C)=C[C@@]([H])(C(=O)O[C@@]4([H])C[C@@]([H])(C1)O[C@@]1(CC[C@]([H])(C)[C@]([H])(O1)C1CCCCC1)C4)[C@]23O > InChI=1S/C43H63NO11/c1-24-11-10-14-30-23-50-40-36(44-48)27(4)19-33(43(30,40)47)41(46)52-32-20-31(16-15-25(2)38(24)53-35-21-34(49-6)37(45)28(5)51-35)54-42(22-32)18-17-26(3)39(55-42)29-12-8-7-9-13-29/h10-11,14-15,19,24,26,28-29,31-35,37-40,45,47-48H,7-9,12-13,16-18,20-23H2,1-6H3/b11-10+,25-15+,30-14+,44-36-/t24-,26-,28-,31+,32-,33-,34-,35-,37-,38-,39-,40+,42+,43+/m0/s1 > AFJYYKSVHJGXSN-XHKIUTQPSA-N > C43H63NO11 > 769.973 > 769.440111853 > 11 > 118 > 85.74762918411093 > 0 > 3 > 0 > 0 > (1'R,2R,4'S,5S,6S,8'R,10'E,12'S,13'S,14'E,20'R,21'Z,24'S)-6-cyclohexyl-24'-hydroxy-12'-{[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-21'-(hydroxyimino)-5,11',13',22'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one > 5.09 > 6.208163373333334 > -5.26 > 0 > 7 > 0 > 12.595405534757713 > 9.580613399258752 > -3.5794959345802857 > 154.73 > 206.74740000000006 > 4 > 0 > 4.25e-03 g/l > (1'R,2R,4'S,5S,6S,8'R,10'E,12'S,13'S,14'E,20'R,21'Z,24'S)-6-cyclohexyl-24'-hydroxy-12'-{[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-21'-(hydroxyimino)-5,11',13',22'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one > 0 > Selamectin > 165108-07-6 $$$$