133052584 CDK 1019211303 41 47 0 0 0 0 0 0 0 0999 V2000 3.3674 1.3146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0696 0.5666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0342 -3.0954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9726 4.2521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2743 -4.2521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2706 -0.0964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6121 2.9989 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 2.2477 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8277 -0.1468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4042 0.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4207 -0.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6121 0.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8447 -1.6120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6868 -0.1269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6489 1.3146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0082 1.7801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5957 -0.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7040 -1.6120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1887 -0.1468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -0.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2184 0.5422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3674 2.2457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -2.2745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8201 0.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0526 -1.6120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6489 2.2457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3236 -2.2745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4042 2.9989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9963 -2.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8470 -1.7839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3374 2.9967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 3.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5145 -3.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4532 2.0617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2743 -3.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9468 3.6205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8615 0.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5841 3.2415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 2.6706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 3.4552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2442 1.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 16 1 0 0 0 0 2 14 1 0 0 0 0 2 37 1 0 0 0 0 3 23 1 0 0 0 0 3 35 1 0 0 0 0 4 32 2 0 0 0 0 5 35 2 0 0 0 0 6 37 2 0 0 0 0 7 22 1 0 0 0 0 7 28 1 0 0 0 0 7 32 1 0 0 0 0 8 22 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 21 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 12 19 1 0 0 0 0 12 24 1 0 0 0 0 13 18 1 0 0 0 0 13 25 1 0 0 0 0 13 27 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 16 22 1 0 0 0 0 16 26 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 23 29 1 0 0 0 0 23 30 1 0 0 0 0 26 28 1 0 0 0 0 26 34 2 0 0 0 0 27 33 2 0 0 0 0 28 36 2 0 0 0 0 31 32 1 0 0 0 0 31 38 1 0 0 0 0 33 35 1 0 0 0 0 34 39 1 0 0 0 0 36 40 1 0 0 0 0 37 41 1 0 0 0 0 39 40 2 0 0 0 0 M END > CHEBI:180993 > Teraspiridole A_130090 > 2 > (2',3b,6,6,10a,12a-hexamethyl-1',8-dioxospiro[3,3a,4,5,5a,10b,11,12-octahydro-[1]benzouro[5,4-g][2]benzoxepine-2,4'-3,3a-dihydro-2H-imidazo[1,2-a]indole]-4-yl) acetate > C33H42N2O6 > 562.707 > 562.30429 > 0 > O1C2(C(C3(C(C4(C(CC3OC(=O)C)C(OC(=O)C=C4)(C)C)C)CC2)C)CC15C6N(C=7C5=CC=CC7)C(=O)C(N6)C)C > InChI=1S/C33H42N2O6/c1-18-27(38)35-21-11-9-8-10-20(21)33(28(35)34-18)17-24-31(6,41-33)15-12-22-30(5)14-13-26(37)40-29(3,4)23(30)16-25(32(22,24)7)39-19(2)36/h8-11,13-14,18,22-25,28,34H,12,15-17H2,1-7H3 > VMDRKPOWEASMAD-UHFFFAOYSA-N $$$$