44299148 -OEChem-03282408352D 61 68 0 1 0 0 0 0 0999 V2000 7.5253 2.3172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3271 -1.4246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2501 0.6180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9273 -0.6474 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2433 1.2320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0179 -0.0555 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5826 -1.1645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0031 0.3687 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2748 -0.4260 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2619 1.3346 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0519 0.2034 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6936 1.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9425 -0.4737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6005 0.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2853 -1.2819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5776 0.6626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9003 -1.6408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7443 -0.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 1.9757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9733 -1.9990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2582 -1.1089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9019 -0.1301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6436 1.6543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4406 -1.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7162 -2.2780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8672 -0.1689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7979 -3.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7995 2.9882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8535 2.3231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7250 0.6516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2181 -1.8786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5644 -3.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5988 -3.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 3.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0454 3.3403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8412 -0.6781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2351 0.7152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4668 0.6641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3014 1.2593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6745 1.7566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1454 -0.4368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5838 -1.1961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3432 -0.7577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1783 -0.6543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0413 -2.2187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8703 -2.1912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2919 -2.0478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2171 -3.2360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3884 3.1820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2692 2.1157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1634 0.2132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1634 1.0900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2866 1.0900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9366 -2.4310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7705 -2.1600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 -1.3262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0486 -3.6892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 -4.2873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 4.2830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5769 3.7463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 10 1 0 0 0 0 9 2 1 1 0 0 0 2 31 1 0 0 0 0 3 26 2 0 0 0 0 4 8 1 0 0 0 0 4 13 1 0 0 0 0 4 17 1 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 5 19 1 0 0 0 0 11 6 1 1 0 0 0 6 30 1 0 0 0 0 6 44 1 0 0 0 0 7 24 1 0 0 0 0 7 26 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 6 0 0 0 9 11 1 0 0 0 0 9 36 1 0 0 0 0 10 12 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 20 1 0 0 0 0 15 21 2 0 0 0 0 16 22 2 0 0 0 0 16 23 1 0 0 0 0 17 20 1 0 0 0 0 17 25 2 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 23 1 0 0 0 0 19 28 2 0 0 0 0 20 27 2 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 26 1 0 0 0 0 23 29 2 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 32 1 0 0 0 0 25 47 1 0 0 0 0 27 33 1 0 0 0 0 27 48 1 0 0 0 0 28 34 1 0 0 0 0 28 49 1 0 0 0 0 29 35 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 32 33 2 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 34 35 2 0 0 0 0 34 60 1 0 0 0 0 35 61 1 0 0 0 0 M END > 44299148 > 1 > 901 > 4 > 2 > 2 > AAADceB7sAAAAAAAAAAAAAAAAAAAAWLFgAA0YMEABYAAAFix/gAAHgAQAAAADDzhngYywPPMFACoAyVyVACCgCQlEiAI2KE4dNgLYPLA1ZGfIQhmlgDayQf82cOeyAACQAASACCQAASAACQAQAAAAAAAAA== > (2S,3R,4R)-3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one > (2S,3R,4R)-3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one > (2S,3R,4R)-3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one > (2S,3R,4R)-3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one > (2S,3R,4R)-3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one > (2S,3R,4R)-3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one > InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20?,26-,28+/m1/s1 > HKSZLNNOFSGOKW-ZGQXJOJZSA-N > 3.2 > 466.20049070 > C28H26N4O3 > 466.5 > CC12C(C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)NC)OC > C[C@@]12[C@@H]([C@@H](CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)NC)OC > 69.4 > 466.20049070 > 0 > 35 > 3 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 12 3 13 14 8 13 15 8 14 16 8 15 20 8 15 21 8 16 22 8 16 23 8 17 20 8 17 25 8 19 23 8 19 28 8 9 2 5 20 27 8 21 22 8 23 29 8 25 32 8 27 33 8 28 34 8 29 35 8 32 33 8 34 35 8 4 13 8 4 17 8 5 14 8 5 19 8 11 6 5 8 18 6 $$$$