162859 -OEChem-09272320492D 177186 0 1 0 0 0 0 0999 V2000 20.0976 5.6744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5580 4.6420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0654 3.5830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2972 7.4663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7938 6.6060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1490 2.6568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3723 3.9229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9463 4.1645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.8411 6.6544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2830 4.1569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.5615 5.6344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4170 1.6568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.5384 3.6345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6849 2.6568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9231 2.1647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6849 4.6569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6849 1.6568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4170 -0.3432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6849 -1.3432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9529 -0.3432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8189 -1.8432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2208 -1.3432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2208 -3.3432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9529 -4.3431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0298 -4.9309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4608 -4.6219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7698 -6.1910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5868 -7.3820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5588 4.1571 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 17.3348 4.1502 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.4209 3.6504 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.6889 3.6638 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.3508 5.1917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.5507 5.1987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2905 5.7342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4528 5.7195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6812 2.6638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2572 3.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7832 2.1360 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.4132 2.6504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7991 4.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8811 2.6568 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.2259 5.1845 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.8891 3.6984 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.9219 4.9280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2092 4.0996 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.3194 3.1503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5433 2.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3541 4.6061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7999 1.0512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9332 2.1289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8645 0.5014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7938 6.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7938 6.6022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9248 1.0439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0151 3.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3678 -0.3627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3678 -0.3665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9578 5.1645 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 21.8296 5.6544 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2830 3.1568 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 22.6898 5.1444 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 21.8065 3.6546 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.6782 4.1445 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4170 2.6568 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5510 3.1568 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 21.7949 2.6546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4170 4.6569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5510 4.1569 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5510 1.1568 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5510 0.1568 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6849 -0.3432 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8189 1.1568 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8189 0.1568 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9529 1.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9529 -1.3432 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0868 -1.8432 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0868 -2.8432 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8189 -2.8432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9529 -3.3432 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2208 -4.3431 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4118 -4.9309 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7208 -5.8820 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7208 -5.8820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7208 -6.8820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1504 3.2141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3541 6.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3372 5.7807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9407 5.0879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8538 6.1924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0555 6.1954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8455 3.1155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6434 3.0940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5241 1.7196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6207 2.0662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0246 2.7534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2073 4.6720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4092 4.6873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7586 4.8673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2775 3.5967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3999 5.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5270 5.4060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4439 4.5332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7514 4.4003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6994 3.1599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3098 2.5304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9393 3.1408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5386 1.5371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9384 4.8136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1466 5.1903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7699 4.3985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0179 0.4708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4090 1.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7286 2.7142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3215 2.0275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2672 6.1980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2703 6.9950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3772 6.8120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6885 7.2132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3148 1.1547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7113 0.4619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9620 5.1123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0535 2.9632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8321 -0.6747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6799 -0.8984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9035 -0.0506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8297 -0.0586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0599 -0.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9059 -0.6744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4173 4.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6092 8.0020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4859 7.1442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2963 5.9706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2830 2.5368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.6969 5.7644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2660 3.3508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2187 4.4483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8800 2.3468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3816 6.9581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0140 3.4668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.0002 2.0696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.4067 2.7552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8155 5.1318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0184 5.1318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5510 4.7768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.0948 5.3182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.5312 3.0146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5510 1.7768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 2.9668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9160 1.5447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6849 5.2768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5510 -0.4632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 -0.6532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8189 1.7768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8189 -0.4632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9539 -0.0332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2629 2.1938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4159 1.9668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6429 1.1199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2219 -1.6532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4159 -1.0332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0868 -1.2232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0868 -3.4632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4898 -3.6532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0310 -3.4258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4295 -2.7355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6839 -1.6532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6684 -4.0617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4898 -4.6532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9734 -5.3694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -6.4986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3273 -6.0109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1102 -6.7743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5088 -7.4646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6409 -6.7975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5868 -8.0020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 43 1 1 1 0 0 0 59 1 1 1 0 0 0 44 2 1 6 0 0 0 2122 1 0 0 0 0 46 3 1 1 0 0 0 3123 1 0 0 0 0 4 53 1 0 0 0 0 4131 1 0 0 0 0 5 54 1 0 0 0 0 5132 1 0 0 0 0 6 56 1 0 0 0 0 61 6 1 1 0 0 0 7 56 2 0 0 0 0 8 59 1 0 0 0 0 8 63 1 0 0 0 0 60 9 1 6 0 0 0 9139 1 0 0 0 0 10 61 1 0 0 0 0 10 68 1 0 0 0 0 62 11 1 1 0 0 0 11146 1 0 0 0 0 65 12 1 6 0 0 0 70 12 1 1 0 0 0 64 13 1 6 0 0 0 13147 1 0 0 0 0 66 14 1 1 0 0 0 14149 1 0 0 0 0 15 67 1 0 0 0 0 15150 1 0 0 0 0 69 16 1 1 0 0 0 16151 1 0 0 0 0 17 70 1 0 0 0 0 17 73 1 0 0 0 0 71 18 1 6 0 0 0 18156 1 0 0 0 0 72 19 1 6 0 0 0 19160 1 0 0 0 0 74 20 1 1 0 0 0 76 20 1 6 0 0 0 21 76 1 0 0 0 0 21 79 1 0 0 0 0 77 22 1 1 0 0 0 22167 1 0 0 0 0 78 23 1 6 0 0 0 81 23 1 6 0 0 0 80 24 1 1 0 0 0 24169 1 0 0 0 0 25 81 1 0 0 0 0 25 84 1 0 0 0 0 82 26 1 1 0 0 0 26175 1 0 0 0 0 83 27 1 1 0 0 0 27176 1 0 0 0 0 28 85 1 0 0 0 0 28177 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 29 34 1 0 0 0 0 29 45 1 1 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 30 38 1 0 0 0 0 30 47 1 1 0 0 0 31 40 1 0 0 0 0 31 86 1 6 0 0 0 32 37 1 0 0 0 0 32 41 1 0 0 0 0 32 49 1 6 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 33 87 1 6 0 0 0 34 36 1 0 0 0 0 34 88 1 0 0 0 0 34 89 1 0 0 0 0 35 43 1 0 0 0 0 35 53 1 0 0 0 0 35 54 1 0 0 0 0 36 90 1 0 0 0 0 36 91 1 0 0 0 0 37 39 1 0 0 0 0 37 48 2 0 0 0 0 38 46 1 0 0 0 0 38 92 1 0 0 0 0 38 93 1 0 0 0 0 39 42 1 0 0 0 0 39 50 1 0 0 0 0 39 94 1 1 0 0 0 40 48 1 0 0 0 0 40 95 1 0 0 0 0 40 96 1 0 0 0 0 41 44 1 0 0 0 0 41 97 1 0 0 0 0 41 98 1 0 0 0 0 42 44 1 0 0 0 0 42 51 1 0 0 0 0 42 56 1 1 0 0 0 43 46 1 0 0 0 0 43 99 1 0 0 0 0 44100 1 0 0 0 0 45101 1 0 0 0 0 45102 1 0 0 0 0 45103 1 0 0 0 0 46104 1 0 0 0 0 47105 1 0 0 0 0 47106 1 0 0 0 0 47107 1 0 0 0 0 48108 1 0 0 0 0 49109 1 0 0 0 0 49110 1 0 0 0 0 49111 1 0 0 0 0 50 52 1 0 0 0 0 50112 1 0 0 0 0 50113 1 0 0 0 0 51 55 1 0 0 0 0 51114 1 0 0 0 0 51115 1 0 0 0 0 52 55 1 0 0 0 0 52 57 1 0 0 0 0 52 58 1 0 0 0 0 53116 1 0 0 0 0 53117 1 0 0 0 0 54118 1 0 0 0 0 54119 1 0 0 0 0 55120 1 0 0 0 0 55121 1 0 0 0 0 57124 1 0 0 0 0 57125 1 0 0 0 0 57126 1 0 0 0 0 58127 1 0 0 0 0 58128 1 0 0 0 0 58129 1 0 0 0 0 59 60 1 0 0 0 0 59130 1 0 0 0 0 60 62 1 0 0 0 0 60133 1 0 0 0 0 61 65 1 0 0 0 0 61134 1 0 0 0 0 62 64 1 0 0 0 0 62135 1 0 0 0 0 63 64 1 0 0 0 0 63 67 1 1 0 0 0 63136 1 0 0 0 0 64137 1 0 0 0 0 65 66 1 0 0 0 0 65138 1 0 0 0 0 66 69 1 0 0 0 0 66140 1 0 0 0 0 67141 1 0 0 0 0 67142 1 0 0 0 0 68 69 1 0 0 0 0 68143 1 0 0 0 0 68144 1 0 0 0 0 69145 1 0 0 0 0 70 71 1 0 0 0 0 70148 1 0 0 0 0 71 72 1 0 0 0 0 71152 1 0 0 0 0 72 74 1 0 0 0 0 72153 1 0 0 0 0 73 74 1 0 0 0 0 73 75 1 6 0 0 0 73154 1 0 0 0 0 74155 1 0 0 0 0 75157 1 0 0 0 0 75158 1 0 0 0 0 75159 1 0 0 0 0 76 77 1 0 0 0 0 76161 1 0 0 0 0 77 78 1 0 0 0 0 77162 1 0 0 0 0 78 80 1 0 0 0 0 78163 1 0 0 0 0 79 80 1 0 0 0 0 79165 1 0 0 0 0 79166 1 0 0 0 0 80164 1 0 0 0 0 81 82 1 0 0 0 0 81168 1 0 0 0 0 82 83 1 0 0 0 0 82170 1 0 0 0 0 83 84 1 0 0 0 0 83 85 1 0 0 0 0 84171 1 0 0 0 0 84172 1 0 0 0 0 85173 1 0 0 0 0 85174 1 0 0 0 0 M END > 162859 > 1 > 2380 > 28 > 17 > 15 > AAADcfB8PgAAAAAAAAAAAAAAAAAAASAAAAA0aNGiAAAAAADAAAAAGgAACAAAD1SwgAMCCAAABgCIAiDSCAAAAAAgAAAACAEAAAgREBYAAQAiQAAFoAAPAAPI6PyPgAAAAAAAAADAAAYAADCAAAAAAAAAAA== > [(2S,3R,4S,5S)-3-[(2S,3R,4S,5R,6S)-5-[(2S,3R,4S,5R)-4-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]oxy-3,5-dihydroxy-tetrahydropyran-2-yl]oxy-3,4-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4,5-dihydroxy-tetrahydropyran-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10R,11S,12aR,14bS)-5,11-dihydroxy-9,9-bis(hydroxymethyl)-2,2,6a,6b,12a-pentamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate > (4aR,5R,6aR,6aS,6bR,8aR,10R,11S,12aR,14bS)-5,11-dihydroxy-9,9-bis(hydroxymethyl)-2,2,6a,6b,12a-pentamethyl-10-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid [(2S,3R,4S,5S)-3-[[(2S,3R,4S,5R,6S)-5-[[(2S,3R,4S,5R)-4-[[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)-2-oxolanyl]oxy]-3,5-dihydroxy-2-oxanyl]oxy]-3,4-dihydroxy-6-methyl-2-oxanyl]oxy]-4,5-dihydroxy-2-oxanyl] ester > [(2S,3R,4S,5S)-3-[(2S,3R,4S,5R,6S)-5-[(2S,3R,4S,5R)-4-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-3,5-dihydroxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10R,11S,12aR,14bS)-5,11-dihydroxy-9,9-bis(hydroxymethyl)-2,2,6a,6b,12a-pentamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate > [(2S,3R,4S,5S)-3-[(2S,3R,4S,5R,6S)-5-[(2S,3R,4S,5R)-4-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-3,5-dihydroxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10R,11S,12aR,14bS)-5,11-dihydroxy-9,9-bis(hydroxymethyl)-2,2,6a,6b,12a-pentamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate > [(2S,3R,4S,5S)-3-[(2S,3R,4S,5R,6S)-5-[(2S,3R,4S,5R)-4-[(2S,3R,4R)-4-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxy-3,5-bis(oxidanyl)oxan-2-yl]oxy-6-methyl-3,4-bis(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10R,11S,12aR,14bS)-9,9-bis(hydroxymethyl)-10-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-2,2,6a,6b,12a-pentamethyl-5,11-bis(oxidanyl)-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate > (4aR,5R,6aR,6aS,6bR,8aR,10R,11S,12aR,14bS)-5,11-dihydroxy-2,2,6a,6b,12a-pentamethyl-9,9-dimethylol-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid [(2S,3R,4S,5S)-3-[(2S,3R,4S,5R,6S)-5-[(2S,3R,4S,5R)-4-[(2S,3R,4R)-3,4-dihydroxy-4-methylol-tetrahydrofuran-2-yl]oxy-3,5-dihydroxy-tetrahydropyran-2-yl]oxy-3,4-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4,5-dihydroxy-tetrahydropyran-2-yl] ester > InChI=1S/C57H92O28/c1-23-40(81-45-39(72)41(28(64)18-76-45)82-49-43(73)56(75,21-61)22-78-49)36(69)38(71)46(79-23)83-42-33(66)27(63)17-77-48(42)85-50(74)57-12-11-51(2,3)13-25(57)24-7-8-30-52(4)14-26(62)44(84-47-37(70)35(68)34(67)29(16-58)80-47)55(19-59,20-60)31(52)9-10-53(30,5)54(24,6)15-32(57)65/h7,23,25-49,58-73,75H,8-22H2,1-6H3/t23-,25-,26-,27-,28+,29+,30+,31+,32+,33-,34+,35-,36-,37+,38+,39+,40-,41-,42+,43-,44-,45-,46-,47-,48-,49-,52+,53+,54+,56+,57+/m0/s1 > CYBWUNOAQPMRBA-NDTOZIJESA-N > -3.7 > 1224.57751227 > C57H92O28 > 1225.3 > CC1C(C(C(C(O1)OC2C(C(COC2OC(=O)C34CCC(CC3C5=CCC6C(C5(CC4O)C)(CCC7C6(CC(C(C7(CO)CO)OC8C(C(C(C(O8)CO)O)O)O)O)C)C)(C)C)O)O)O)O)OC9C(C(C(CO9)O)OC1C(C(CO1)(CO)O)O)O > C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H](CO[C@H]2OC(=O)[C@]34CCC(C[C@H]3C5=CC[C@H]6[C@]([C@@]5(C[C@H]4O)C)(CC[C@@H]7[C@@]6(C[C@@H]([C@@H](C7(CO)CO)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)C)C)(C)C)O)O)O)O)O[C@H]9[C@@H]([C@H]([C@@H](CO9)O)O[C@H]1[C@@H]([C@](CO1)(CO)O)O)O > 453 > 1224.57751227 > 0 > 85 > 31 > 0 > 0 > 0 > 0 > 1 > 1 > 1 5 255 > 43 1 5 59 1 5 62 11 5 65 12 6 70 12 5 64 13 6 66 14 5 69 16 5 71 18 6 72 19 6 44 2 6 74 20 5 76 20 6 77 22 5 78 23 6 81 23 6 80 24 5 82 26 5 83 27 5 29 45 5 46 3 5 30 47 5 31 86 6 32 49 6 33 87 6 39 94 5 42 56 5 61 6 5 63 67 5 73 75 6 60 9 6 $$$$