70541180 -OEChem-05092413472D 118122 0 1 0 0 0 0 0999 V2000 8.3282 0.5381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5669 6.5205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3090 7.7828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 8.2123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8339 10.4245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 6.2123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5659 12.4245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 5.2123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8339 13.4245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 8.2123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1018 10.4245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6246 2.9579 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.4906 2.4579 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7146 2.4510 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.3567 2.9579 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3567 3.9579 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7066 1.4095 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.6246 3.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4906 4.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5067 1.4164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3029 4.2626 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.3029 2.6532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6086 0.8886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7878 3.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9818 3.7239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8865 3.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7712 0.8597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3798 3.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8315 1.4022 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.3567 4.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8399 2.4872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6135 5.2131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3238 4.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8315 1.4061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5651 5.5205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0271 6.0232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6810 5.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3349 2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6163 6.8312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3349 2.2779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 6.7123 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6999 11.9245 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2690 6.2123 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8339 12.4245 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4030 7.7123 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6999 10.9245 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1350 6.7123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9678 11.9245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 7.7123 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.9678 10.9245 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5369 8.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5659 10.4245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0299 2.1520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4223 2.3414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7098 0.5595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4125 4.5405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0140 3.8502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8892 4.9328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0921 4.9328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7247 0.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1158 1.5319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9154 4.3588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0518 2.0862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8403 2.3439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2113 0.4127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0096 0.4157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1960 3.4818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3978 3.4972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4449 4.0339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5833 3.2490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3473 3.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3473 3.8726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3738 0.3838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1721 0.3868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9641 3.6009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1723 3.9776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7956 3.1858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9767 4.9579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3567 5.5779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7367 4.9579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6353 3.0725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2282 2.3858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9344 4.7713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2481 1.1963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9368 0.7951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6930 4.9138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1818 5.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6361 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4072 6.0242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8931 6.0123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0705 5.3220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6469 2.8098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0269 2.8160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0228 1.7421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 7.0223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2368 11.6145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8059 5.9023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3708 12.7345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 8.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6999 10.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3471 6.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7456 6.8199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7558 12.5071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3572 11.8169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 7.4023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9678 10.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 8.7492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.5223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 7.6753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2559 9.8876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1028 10.1145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8759 10.9615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.5223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1028 12.1145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8059 4.9023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2969 13.7345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 8.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1018 9.8045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 29 1 1 1 0 0 0 1 88 1 0 0 0 0 2 35 1 0 0 0 0 2 39 1 0 0 0 0 3 39 2 0 0 0 0 4 45 1 0 0 0 0 4 49 1 0 0 0 0 5 46 1 0 0 0 0 5 50 1 0 0 0 0 41 6 1 6 0 0 0 6113 1 0 0 0 0 42 7 1 6 0 0 0 7114 1 0 0 0 0 43 8 1 6 0 0 0 8115 1 0 0 0 0 44 9 1 6 0 0 0 9116 1 0 0 0 0 10 49 1 0 0 0 0 10117 1 0 0 0 0 11 50 1 0 0 0 0 11118 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 12 25 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 13 53 1 0 0 0 0 14 17 1 0 0 0 0 14 24 1 0 0 0 0 14 28 1 1 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 15 54 1 0 0 0 0 16 19 1 0 0 0 0 16 21 1 0 0 0 0 16 30 1 1 0 0 0 17 23 1 0 0 0 0 17 27 1 0 0 0 0 17 55 1 1 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 23 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 21 26 1 0 0 0 0 21 32 1 1 0 0 0 21 62 1 0 0 0 0 22 26 1 0 0 0 0 22 63 1 0 0 0 0 22 64 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 31 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 33 1 0 0 0 0 25 69 1 0 0 0 0 25 70 1 0 0 0 0 26 71 1 0 0 0 0 26 72 1 0 0 0 0 27 29 1 0 0 0 0 27 73 1 0 0 0 0 27 74 1 0 0 0 0 28 75 1 0 0 0 0 28 76 1 0 0 0 0 28 77 1 0 0 0 0 29 31 1 0 0 0 0 29 34 1 0 0 0 0 30 78 1 0 0 0 0 30 79 1 0 0 0 0 30 80 1 0 0 0 0 31 81 1 0 0 0 0 31 82 1 0 0 0 0 32 35 1 0 0 0 0 32 36 2 0 0 0 0 33 37 2 0 0 0 0 33 83 1 0 0 0 0 34 38 1 0 0 0 0 34 84 1 0 0 0 0 34 85 1 0 0 0 0 35 86 1 0 0 0 0 35 87 1 0 0 0 0 36 39 1 0 0 0 0 36 89 1 0 0 0 0 37 90 1 0 0 0 0 37 91 1 0 0 0 0 38 40 2 0 0 0 0 38 92 1 0 0 0 0 40 93 1 0 0 0 0 40 94 1 0 0 0 0 41 43 1 0 0 0 0 41 45 1 0 0 0 0 41 95 1 0 0 0 0 42 44 1 0 0 0 0 42 46 1 0 0 0 0 42 96 1 0 0 0 0 43 47 1 0 0 0 0 43 97 1 0 0 0 0 44 48 1 0 0 0 0 44 98 1 0 0 0 0 45 51 1 1 0 0 0 45 99 1 0 0 0 0 46 52 1 1 0 0 0 46100 1 0 0 0 0 47 49 1 0 0 0 0 47101 1 0 0 0 0 47102 1 0 0 0 0 48 50 1 0 0 0 0 48103 1 0 0 0 0 48104 1 0 0 0 0 49105 1 0 0 0 0 50106 1 0 0 0 0 51107 1 0 0 0 0 51108 1 0 0 0 0 51109 1 0 0 0 0 52110 1 0 0 0 0 52111 1 0 0 0 0 52112 1 0 0 0 0 M END > 70541180 > 1 > 960 > 11 > 7 > 5 > AAADcfB8PAAAAAAAAAAAAAAAAAAAAYIAAAA0aMECAAAAAGDAAAAAGgAACAAAD1SwgAMCCAAABgCIAiDSCAAAAAAgAAAICAAAAEgRFAIAIQACUAAFwAAPIQPA4PQPgAAAAAAAAADAAAYAACAAAQAACAAAAA== > 3-[(3R,5R,10S,13S,17S)-3,9-diallyl-3-hydroxy-10,13-dimethyl-2,4,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one;(4S,5S,6R)-6-methyltetrahydropyran-2,4,5-triol > 3-[(3R,5R,10S,13S,17S)-3-hydroxy-10,13-dimethyl-3,9-bis(prop-2-enyl)-2,4,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one;(4S,5S,6R)-6-methyloxane-2,4,5-triol > 3-[(3R,5R,10S,13S,17S)-3-hydroxy-10,13-dimethyl-3,9-bis(prop-2-enyl)-2,4,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one;(4S,5S,6R)-6-methyloxane-2,4,5-triol > 3-[(3R,5R,10S,13S,17S)-3-hydroxy-10,13-dimethyl-3,9-bis(prop-2-enyl)-2,4,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one;(4S,5S,6R)-6-methyloxane-2,4,5-triol > 3-[(3R,5R,10S,13S,17S)-10,13-dimethyl-3-oxidanyl-3,9-bis(prop-2-enyl)-2,4,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one;(4S,5S,6R)-6-methyloxane-2,4,5-triol > 3-[(3R,5R,10S,13S,17S)-3,9-diallyl-3-hydroxy-10,13-dimethyl-2,4,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one;(4S,5S,6R)-6-methyltetrahydropyran-2,4,5-triol > InChI=1S/C29H42O3.2C6H12O4/c1-5-11-28(31)15-14-27(4)21(18-28)7-8-24-23-10-9-22(20-17-25(30)32-19-20)26(23,3)13-16-29(24,27)12-6-2;2*1-3-6(9)4(7)2-5(8)10-3/h5-6,17,21-24,31H,1-2,7-16,18-19H2,3-4H3;2*3-9H,2H2,1H3/t21-,22-,23?,24?,26-,27+,28+,29?;2*3-,4+,5?,6-/m111/s1 > OXYJKFGDMYWFCC-PWXFOHSNSA-N > 734.46051292 > C41H66O11 > 735.0 > CC1C(C(CC(O1)O)O)O.CC1C(C(CC(O1)O)O)O.CC12CCC(CC1CCC3C2(CCC4(C3CCC4C5=CC(=O)OC5)C)CC=C)(CC=C)O > C[C@@H]1[C@H]([C@H](CC(O1)O)O)O.C[C@@H]1[C@H]([C@H](CC(O1)O)O)O.C[C@]12CC[C@](C[C@H]1CCC3C2(CC[C@]4(C3CC[C@@H]4C5=CC(=O)OC5)C)CC=C)(CC=C)O > 186 > 734.46051292 > 0 > 52 > 11 > 5 > 0 > 0 > 0 > 3 > -1 > 1 5 255 > 29 1 5 49 10 3 50 11 3 12 25 3 13 20 3 14 28 5 15 22 3 16 30 5 17 55 5 21 32 5 45 51 5 46 52 5 41 6 6 42 7 6 43 8 6 44 9 6 $$$$