null CDK 0224162302 null 42 46 0 0 0 0 0 0 0 0999 V2000 4.1783 -3.1290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9602 -2.8659 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9769 -2.0411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1976 -1.7703 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6993 -2.4278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -3.2244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8208 -2.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -3.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0895 -4.0394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4654 -4.5789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6205 -5.3891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3998 -5.6599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -5.1204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8688 -4.3101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8998 -3.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2496 -4.3532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5204 -3.5739 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3338 -3.4364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8596 -4.0721 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6731 -3.9346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 -4.8454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0978 -5.4811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9113 -5.3436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4371 -5.9793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1495 -6.7525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3360 -6.8900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8102 -6.2543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0484 -7.6633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5742 -8.2990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2349 -7.8008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7252 -3.3985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1608 -4.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3575 -3.8124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1185 -3.0228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6829 -2.4210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4862 -2.6089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1633 -2.1376 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -1.3127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9586 -0.9807 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1553 -0.7929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5230 -0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3263 -0.5667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 9 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 2 1 0 0 0 0 17 18 1 6 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 22 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 8 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 31 1 0 0 0 0 36 37 1 0 0 0 0 37 7 1 0 0 0 0 37 38 1 0 0 0 0 4 39 1 0 0 0 0 39 40 1 1 0 0 0 39 41 1 0 0 0 0 41 42 1 0 0 0 0 M END > CHEBI:99071 > LSM-10450 > 2 > C34H39N3O5 > 569.692 > 569.28897 > 0 > C[C@H]1CN(C(=O)C2=C(C3=CC=CC=C3CO[C@H]1CN(C)CC4=CC=CC(=C4)C(=O)O)C5=CC=CC=C5N2C)[C@@H](C)CO > InChI=1S/C34H39N3O5/c1-22-17-37(23(2)20-38)33(39)32-31(28-14-7-8-15-29(28)36(32)4)27-13-6-5-11-26(27)21-42-30(22)19-35(3)18-24-10-9-12-25(16-24)34(40)41/h5-16,22-23,30,38H,17-21H2,1-4H3,(H,40,41)/t22-,23-,30-/m0/s1 > LTECXWQWCPQLLD-ZRLASMASSA-N > LSM-10450 $$$$