10436341 -OEChem-04192421252D 79 83 0 1 0 0 0 0 0999 V2000 8.9887 3.9376 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 8.7824 4.9161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.6806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.6806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1949 2.9591 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3194 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4103 1.6242 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0102 3.7314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.3194 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7210 2.5747 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6995 2.7809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 0.8194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8039 4.7099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0596 4.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 0.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0531 3.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9672 4.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6350 3.3995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2778 5.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6135 3.6058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2563 5.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9242 4.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.1806 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 -4.1806 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 -4.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 1.7560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5540 -0.5258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1143 2.4468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7201 2.1612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3133 2.6935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4548 0.4047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4548 1.2341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3792 4.9412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4763 5.2363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5717 4.4246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7676 3.4952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1593 -0.5522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9477 -0.2945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 2.2944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 2.2944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0841 2.3194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.9394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8441 2.3194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 1.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 1.2118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 0.4271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -0.2632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5146 3.7330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6391 3.7804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5917 2.9049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.4906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7842 2.7665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4424 2.8102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8638 5.5558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.3706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0276 3.1443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4489 5.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5308 4.6841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -2.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -3.2882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.8006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.8006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -5.1555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -5.1555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.9906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.3006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.3006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 2 0 0 0 0 1 8 1 0 0 0 0 1 22 1 0 0 0 0 33 3 1 6 0 0 0 3 78 1 0 0 0 0 34 4 1 1 0 0 0 4 79 1 0 0 0 0 5 63 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 1 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 7 37 1 6 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 15 1 0 0 0 0 9 18 1 0 0 0 0 9 38 1 6 0 0 0 10 11 1 0 0 0 0 10 21 1 6 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 15 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 19 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 20 1 0 0 0 0 18 23 2 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 21 61 1 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 23 26 1 0 0 0 0 23 62 1 0 0 0 0 24 28 1 0 0 0 0 24 64 1 0 0 0 0 25 29 2 0 0 0 0 25 65 1 0 0 0 0 26 27 2 0 0 0 0 26 66 1 0 0 0 0 27 31 1 0 0 0 0 27 32 1 0 0 0 0 28 30 2 0 0 0 0 28 67 1 0 0 0 0 29 30 1 0 0 0 0 29 68 1 0 0 0 0 30 69 1 0 0 0 0 31 33 1 0 0 0 0 31 70 1 0 0 0 0 31 71 1 0 0 0 0 32 34 1 0 0 0 0 32 36 2 0 0 0 0 33 35 1 0 0 0 0 33 72 1 0 0 0 0 34 35 1 0 0 0 0 34 73 1 0 0 0 0 35 74 1 0 0 0 0 35 75 1 0 0 0 0 36 76 1 0 0 0 0 36 77 1 0 0 0 0 M END > 10436341 > 1 > 1030 > 4 > 3 > 6 > AAADcfB6MABAAAAAAAAAAAAAGAAAAYAAAAAwYMAAAAAAAGABAAAAGgQQSAAADxSg0AIyAYAAAgqAAiBCAEBCAAAgCBAIiBgAAIgINCKgERCAYAAlwAAomAeA4MQPgAAAAAAAAAAAAAAQACAAAQAACAAAAA== > (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(1R)-1-methyl-2-[1-(phenylsulfonimidoyl)cyclopropyl]ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diol > (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-1-[1-(phenylsulfonimidoyl)cyclopropyl]propan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylenecyclohexane-1,3-diol > (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-1-[1-(phenylsulfonimidoyl)cyclopropyl]propan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol > (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-1-[1-(phenylsulfonimidoyl)cyclopropyl]propan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol > (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-1-[1-(phenylsulfonimidoyl)cyclopropyl]propan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidene-cyclohexane-1,3-diol > (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(1R)-1-methyl-2-[1-(phenylsulfonimidoyl)cyclopropyl]ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diol > InChI=1S/C31H43NO3S/c1-21(20-31(16-17-31)36(32,35)26-9-5-4-6-10-26)27-13-14-28-23(8-7-15-30(27,28)3)11-12-24-18-25(33)19-29(34)22(24)2/h4-6,9-12,21,25,27-29,32-34H,2,7-8,13-20H2,1,3H3/b23-11+,24-12-/t21-,25-,27-,28+,29+,30-,36?/m1/s1 > UZXBJQXQZHYYIV-SFYOVDSCSA-N > 6.8 > 509.29636541 > C31H43NO3S > 509.7 > CC(CC1(CC1)S(=N)(=O)C2=CC=CC=C2)C3CCC4C3(CCCC4=CC=C5CC(CC(C5=C)O)O)C > C[C@H](CC1(CC1)S(=N)(=O)C2=CC=CC=C2)[C@H]3CC[C@@H]\4[C@@]3(CCC/C4=C\C=C/5\C[C@H](C[C@@H](C5=C)O)O)C > 89.8 > 509.29636541 > 0 > 36 > 6 > 1 > 2 > 0 > 0 > 1 > -1 > 1 5 255 > 1 22 3 10 21 6 22 24 8 22 25 8 24 28 8 25 29 8 28 30 8 29 30 8 33 3 6 34 4 5 6 17 5 7 37 6 9 38 6 $$$$