70695952 -OEChem-04262419282D 157164 0 1 0 0 0 0 0999 V2000 11.4494 4.2172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7741 -3.5350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5495 5.8195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7340 6.8584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1733 5.5180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2182 -2.8433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 -3.5350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7741 -5.5350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6834 7.3196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 6.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 -6.5350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -5.5350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 -7.0350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -2.5349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 -4.0350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -7.2670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5061 -6.5350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5061 -8.5350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -5.5349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7741 -9.5350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -7.2670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3101 -8.9991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6751 1.1653 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8110 0.6619 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7990 -0.3796 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6713 2.1653 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6991 -0.9039 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5871 0.6619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8033 2.6619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7833 3.7034 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6793 4.2346 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5991 -0.3796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7116 -1.9888 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.5793 2.6756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9431 1.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8491 -0.9039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5833 3.7172 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6593 1.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7741 -2.5349 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9392 2.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9349 0.1237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8293 4.2203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8365 -1.9888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6568 1.9954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6834 5.3195 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8084 5.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7417 5.8584 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5394 4.7446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7116 -1.9811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2183 -2.8510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8085 5.2897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2951 6.1633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 -4.0350 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.5495 6.8196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 -5.0350 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8642 7.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 -5.5350 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1760 -4.0350 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1760 -5.0350 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4155 7.3196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8564 8.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7741 -6.5350 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3100 -3.5350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7186 8.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9866 8.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6401 -7.0350 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8101 -6.4010 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6401 -8.0350 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9789 9.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -6.4010 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9080 -8.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7741 -8.5350 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3100 -7.2670 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8100 -8.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8101 -8.1331 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5455 0.2341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4384 -1.3232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1991 0.5629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7894 1.2480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0572 3.2614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8149 -0.9609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2087 -0.2665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7861 2.0911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1906 2.7794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 1.2639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7333 0.5752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6468 -0.3178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 -1.0029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1197 3.4062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7693 0.7325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2694 1.4527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5493 1.9529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3116 -2.8439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4011 2.4665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2470 0.6594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3992 0.4358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6228 -0.4120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2166 4.3146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6316 3.6327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2270 -1.8757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6208 -2.5701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5514 1.3844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2677 1.8901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7621 2.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6822 5.9396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2018 6.1632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6185 4.1296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1354 5.2149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2925 -1.7646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5992 -1.3714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6837 -3.1651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5324 -3.3855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7528 -2.5368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9863 3.9072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7990 5.9096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1886 5.2801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8181 4.6697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8272 6.4816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9769 6.6954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7630 5.8451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7851 5.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 -3.4150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8382 -2.8385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 -5.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5051 -5.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 -3.4150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6391 -4.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7255 6.7826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9524 7.6296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1055 7.8565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3110 -6.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 -7.0719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0327 8.3238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2531 9.1725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4045 9.3929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4521 8.5308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1770 -7.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -5.8641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6401 -8.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5989 9.8497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9741 10.4649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3589 9.8402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -6.4010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2975 -7.9273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6960 -8.6176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2371 -8.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0431 -6.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -7.8040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7023 -8.7436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3926 -8.3451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1201 -8.6700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5061 -9.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -5.5349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2371 -9.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -7.8040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -9.5360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 37 1 1 6 0 0 0 1114 1 0 0 0 0 39 2 1 1 0 0 0 53 2 1 1 0 0 0 45 3 1 6 0 0 0 3 54 1 0 0 0 0 47 4 1 1 0 0 0 4 56 1 0 0 0 0 5 48 1 0 0 0 0 5121 1 0 0 0 0 6 49 1 0 0 0 0 6123 1 0 0 0 0 7 53 1 0 0 0 0 7 58 1 0 0 0 0 55 8 1 6 0 0 0 62 8 1 1 0 0 0 9 54 2 0 0 0 0 10 56 2 0 0 0 0 57 11 1 1 0 0 0 11132 1 0 0 0 0 59 12 1 6 0 0 0 67 12 1 6 0 0 0 13 62 1 0 0 0 0 13 71 1 0 0 0 0 14 63 1 0 0 0 0 14143 1 0 0 0 0 15 63 2 0 0 0 0 16 67 1 0 0 0 0 16 74 1 0 0 0 0 66 17 1 6 0 0 0 17148 1 0 0 0 0 68 18 1 1 0 0 0 18153 1 0 0 0 0 70 19 1 1 0 0 0 19154 1 0 0 0 0 72 20 1 6 0 0 0 20155 1 0 0 0 0 73 21 1 6 0 0 0 21156 1 0 0 0 0 75 22 1 1 0 0 0 22157 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 28 1 0 0 0 0 23 38 1 1 0 0 0 24 25 1 0 0 0 0 24 35 1 0 0 0 0 24 76 1 6 0 0 0 25 27 1 0 0 0 0 25 36 1 0 0 0 0 25 41 1 1 0 0 0 26 29 1 0 0 0 0 26 34 1 0 0 0 0 26 44 1 6 0 0 0 27 32 1 0 0 0 0 27 33 1 0 0 0 0 27 77 1 6 0 0 0 28 32 1 0 0 0 0 28 78 1 0 0 0 0 28 79 1 0 0 0 0 29 30 1 0 0 0 0 29 40 2 0 0 0 0 30 31 1 0 0 0 0 30 42 1 0 0 0 0 30 80 1 1 0 0 0 31 37 1 0 0 0 0 31 45 1 0 0 0 0 31 48 1 1 0 0 0 32 81 1 0 0 0 0 32 82 1 0 0 0 0 33 39 1 0 0 0 0 33 49 1 0 0 0 0 33 50 1 6 0 0 0 34 37 1 0 0 0 0 34 83 1 0 0 0 0 34 84 1 0 0 0 0 35 40 1 0 0 0 0 35 85 1 0 0 0 0 35 86 1 0 0 0 0 36 43 1 0 0 0 0 36 87 1 0 0 0 0 36 88 1 0 0 0 0 37 89 1 0 0 0 0 38 90 1 0 0 0 0 38 91 1 0 0 0 0 38 92 1 0 0 0 0 39 43 1 0 0 0 0 39 93 1 0 0 0 0 40 94 1 0 0 0 0 41 95 1 0 0 0 0 41 96 1 0 0 0 0 41 97 1 0 0 0 0 42 46 1 0 0 0 0 42 98 1 0 0 0 0 42 99 1 0 0 0 0 43100 1 0 0 0 0 43101 1 0 0 0 0 44102 1 0 0 0 0 44103 1 0 0 0 0 44104 1 0 0 0 0 45 47 1 0 0 0 0 45105 1 0 0 0 0 46 47 1 0 0 0 0 46 51 1 0 0 0 0 46 52 1 0 0 0 0 47106 1 0 0 0 0 48107 1 0 0 0 0 48108 1 0 0 0 0 49109 1 0 0 0 0 49110 1 0 0 0 0 50111 1 0 0 0 0 50112 1 0 0 0 0 50113 1 0 0 0 0 51115 1 0 0 0 0 51116 1 0 0 0 0 51117 1 0 0 0 0 52118 1 0 0 0 0 52119 1 0 0 0 0 52120 1 0 0 0 0 53 55 1 0 0 0 0 53122 1 0 0 0 0 54 60 1 0 0 0 0 55 57 1 0 0 0 0 55124 1 0 0 0 0 56 61 1 0 0 0 0 57 59 1 0 0 0 0 57125 1 0 0 0 0 58 59 1 0 0 0 0 58 63 1 1 0 0 0 58126 1 0 0 0 0 59127 1 0 0 0 0 60128 1 0 0 0 0 60129 1 0 0 0 0 60130 1 0 0 0 0 61 64 1 0 0 0 0 61 65 2 0 0 0 0 62 66 1 0 0 0 0 62131 1 0 0 0 0 64133 1 0 0 0 0 64134 1 0 0 0 0 64135 1 0 0 0 0 65 69 1 0 0 0 0 65136 1 0 0 0 0 66 68 1 0 0 0 0 66137 1 0 0 0 0 67 70 1 0 0 0 0 67138 1 0 0 0 0 68 72 1 0 0 0 0 68139 1 0 0 0 0 69140 1 0 0 0 0 69141 1 0 0 0 0 69142 1 0 0 0 0 70 73 1 0 0 0 0 70144 1 0 0 0 0 71 72 1 0 0 0 0 71145 1 0 0 0 0 71146 1 0 0 0 0 72147 1 0 0 0 0 73 75 1 0 0 0 0 73149 1 0 0 0 0 74 75 1 0 0 0 0 74150 1 0 0 0 0 74151 1 0 0 0 0 75152 1 0 0 0 0 M END > 70695952 > 1 > 2190 > 22 > 11 > 14 > AAADcfB8PgAAAAAAAAAAAAAAAAAAAAAAAAA0aNGCAAAAAADAAAAAGgAACAAADxSwgAMCCAAABgCIAiDSCAIAAAAgAAAACAFAAEgRFBYAIQQiUAAFoAAPIYPK7PxPgAAAAAAAAADAAAYAADCAAAAAAAAAAA== > (2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8R,8aR,9R,10R,12aS,14aR,14bR)-9-acetoxy-8-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-10-[(E)-2-methylbut-2-enoyl]oxy-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy]tetrahydropyran-2-carboxylic acid > (2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8R,8aR,9R,10R,12aS,14aR,14bR)-9-acetyloxy-8-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-10-[(E)-2-methyl-1-oxobut-2-enoxy]-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5R)-3,4,5-trihydroxy-2-oxanyl]oxy]-2-oxanecarboxylic acid > (2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8R,8aR,9R,10R,12aS,14aR,14bR)-9-acetyloxy-8-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-10-[(E)-2-methylbut-2-enoyl]oxy-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy]oxane-2-carboxylic acid > (2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8R,8aR,9R,10R,12aS,14aR,14bR)-9-acetyloxy-8-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-10-[(E)-2-methylbut-2-enoyl]oxy-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy]oxane-2-carboxylic acid > (2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8R,8aR,9R,10R,12aS,14aR,14bR)-9-acetyloxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-10-[(E)-2-methylbut-2-enoyl]oxy-8-oxidanyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-oxidanyl-3,5-bis[[(2S,3R,4S,5R)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy]oxane-2-carboxylic acid > (2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8R,8aR,9R,10R,12aS,14aR,14bR)-9-acetoxy-8-hydroxy-4,6a,6b,11,11,14b-hexamethyl-10-[(E)-2-methylbut-2-enoyl]oxy-4,8a-dimethylol-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy]tetrahydropyran-2-carboxylic acid > InChI=1S/C53H82O22/c1-10-23(2)44(67)75-41-42(70-24(3)56)53(22-55)26(17-48(41,4)5)25-11-12-30-49(6)15-14-32(50(7,21-54)29(49)13-16-51(30,8)52(25,9)18-31(53)59)71-47-39(73-46-36(63)34(61)28(58)20-69-46)37(64)38(40(74-47)43(65)66)72-45-35(62)33(60)27(57)19-68-45/h10-11,26-42,45-47,54-55,57-64H,12-22H2,1-9H3,(H,65,66)/b23-10+/t26-,27+,28+,29+,30+,31+,32-,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,45-,46-,47+,49-,50+,51+,52+,53-/m0/s1 > UBABTSJIVMIEKX-LYNYJCBVSA-N > 0.8 > 1070.52977424 > C53H82O22 > 1071.2 > CC=C(C)C(=O)OC1C(C2(C(CC1(C)C)C3=CCC4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)CO)OC6C(C(C(C(O6)C(=O)O)OC7C(C(C(CO7)O)O)O)O)OC8C(C(C(CO8)O)O)O)C)CO)OC(=O)C > C/C=C(\C)/C(=O)O[C@H]1[C@@H]([C@@]2([C@@H](C[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@]5(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H](CO8)O)O)O)C)C)[C@@H]2CC1(C)C)C)O)CO)OC(=O)C > 348 > 1070.52977424 > 0 > 75 > 25 > 0 > 1 > 0 > 0 > 1 > -1 > 1 5 255 > 37 1 6 57 11 5 59 12 6 67 12 6 66 17 6 68 18 5 70 19 5 39 2 5 53 2 5 72 20 6 73 21 6 75 22 5 23 38 5 24 76 6 25 41 5 26 44 6 27 77 6 45 3 6 30 80 5 31 48 5 33 50 6 47 4 5 58 63 5 55 8 6 62 8 5 $$$$