@MOLECULE 2-[(2r)-7-oxo-2,3-dihydro-7h-furo[3,2-g]chromen-2-yl]-2-propanyl 6-o-[(2e)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoyl]-beta-d-glucopyranoside 74 78 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -1.2562 -0.6940 0.8617 C.3 1 UNL1 0.2795 2 C -2.6975 -1.2575 0.7631 C.3 1 UNL1 0.0282 3 C -2.7166 -2.7704 1.0261 C.3 1 UNL1 0.0754 4 C -1.6474 -3.4825 0.1778 C.3 1 UNL1 0.0725 5 C -0.2772 -2.8011 0.3856 C.3 1 UNL1 0.0603 6 C -0.9795 2.7108 -0.3690 C.3 1 UNL1 0.0694 7 C -4.3955 2.3961 0.6549 C.ar 1 UNL1 -0.3865 8 C -4.0121 1.3420 -1.9921 C.ar 1 UNL1 -0.0397 9 C 6.9924 0.1185 -0.7658 C.ar 1 UNL1 -0.2191 10 C 6.6219 1.3864 1.7219 C.ar 1 UNL1 -0.2066 11 C 5.5544 0.7469 1.0905 C.ar 1 UNL1 -0.1295 12 C 0.7654 -3.3791 -0.5781 C.3 1 UNL1 -0.0381 13 C 0.9244 1.0127 -0.3451 C.3 1 UNL1 -0.5063 14 C -0.0466 1.8665 1.8269 C.3 1 UNL1 -0.5033 15 C 9.6006 0.2602 -1.8726 C.3 1 UNL1 -0.1852 16 H -3.6436 0.2473 1.6409 H 1 UNL1 0.3408 17 H -4.6903 -2.7955 0.9636 H 1 UNL1 0.3419 18 H -2.3412 -5.2553 0.6888 H 1 UNL1 0.3398 19 H 9.7230 1.9738 1.2602 H 1 UNL1 0.3396 20 C 8.0582 0.7382 -0.1359 C.ar 1 UNL1 0.1066 21 C 7.8704 1.3810 1.1109 C.ar 1 UNL1 0.2095 22 C 5.7342 0.1211 -0.1419 C.ar 1 UNL1 -0.0494 23 O -8.5399 0.6969 0.9212 O.2 1 UNL1 -0.4122 24 O 2.3008 -1.7130 -2.0537 O.2 1 UNL1 -0.5137 25 C -1.5921 2.3014 -1.7324 C.3 1 UNL1 -0.2915 26 O -3.4660 -0.7084 1.8093 O.3 1 UNL1 -0.5565 27 O -3.9446 -3.3132 0.5826 O.3 1 UNL1 -0.5659 28 O -1.4676 -4.8038 0.6390 O.3 1 UNL1 -0.5548 29 O 8.8711 2.0154 1.7690 O.3 1 UNL1 -0.4456 30 C 2.6452 -1.9572 -0.9235 C.2 1 UNL1 0.6140 31 O -1.3835 0.5602 0.2711 O.3 1 UNL1 -0.4397 32 O 2.0257 -2.8793 -0.1404 O.3 1 UNL1 -0.4171 33 O 9.3441 0.8025 -0.5847 O.3 1 UNL1 -0.3406 34 C -7.6218 0.7837 0.1557 C.ar 1 UNL1 0.5995 35 C -3.2126 2.5263 -0.0354 C.ar 1 UNL1 0.3188 36 C -5.4093 1.6877 -0.0236 C.ar 1 UNL1 0.3476 37 C -3.0103 2.0160 -1.3549 C.ar 1 UNL1 -0.1433 38 C -5.2444 1.1588 -1.3150 C.ar 1 UNL1 -0.2710 39 C 3.7685 -1.3614 -0.1869 C.2 1 UNL1 -0.2950 40 C 4.6163 -0.5359 -0.8155 C.2 1 UNL1 -0.0317 41 O -0.3834 -1.4389 0.0197 O.3 1 UNL1 -0.4512 42 O -2.1013 3.1126 0.4750 O.3 1 UNL1 -0.3095 43 O -6.5403 1.5218 0.6833 O.2 1 UNL1 -0.3592 44 C -6.3377 0.4284 -1.8867 C.ar 1 UNL1 0.0387 45 C -7.4746 0.2484 -1.1805 C.ar 1 UNL1 -0.3757 46 C -0.3220 1.5052 0.3708 C.3 1 UNL1 0.2863 47 H -0.8482 -0.6510 1.8883 H 1 UNL1 0.1269 48 H -3.1565 -1.0034 -0.2194 H 1 UNL1 0.1592 49 H -2.6118 -2.9989 2.1120 H 1 UNL1 0.1557 50 H -1.9452 -3.5160 -0.8937 H 1 UNL1 0.1506 51 H 0.0664 -2.8871 1.4410 H 1 UNL1 0.1501 52 H -0.3265 3.5963 -0.4003 H 1 UNL1 0.1502 53 H -4.5577 2.7999 1.6487 H 1 UNL1 0.2047 54 H -6.2181 0.0244 -2.8952 H 1 UNL1 0.1569 55 H -1.5156 3.1118 -2.4785 H 1 UNL1 0.1592 56 H -1.0858 1.4182 -2.1661 H 1 UNL1 0.1793 57 H -3.8798 0.9341 -2.9931 H 1 UNL1 0.1614 58 H -8.3326 -0.3013 -1.5633 H 1 UNL1 0.1902 59 H 3.8569 -1.6307 0.8655 H 1 UNL1 0.1882 60 H 4.5088 -0.3147 -1.8861 H 1 UNL1 0.1719 61 H 0.8511 -4.4785 -0.4678 H 1 UNL1 0.1647 62 H 0.5573 -3.1122 -1.6308 H 1 UNL1 0.1643 63 H 7.1159 -0.3781 -1.7251 H 1 UNL1 0.1687 64 H 6.4950 1.8857 2.6812 H 1 UNL1 0.1795 65 H 4.5733 0.7463 1.5654 H 1 UNL1 0.1627 66 H 1.6307 1.8194 -0.5573 H 1 UNL1 0.1523 67 H 1.4504 0.2494 0.2459 H 1 UNL1 0.1705 68 H 0.6740 0.5142 -1.2957 H 1 UNL1 0.1829 69 H -0.9806 2.1013 2.3591 H 1 UNL1 0.1755 70 H 0.4447 1.0507 2.3676 H 1 UNL1 0.1563 71 H 0.6011 2.7467 1.9048 H 1 UNL1 0.1591 72 H 9.0150 0.7766 -2.6397 H 1 UNL1 0.1362 73 H 10.6726 0.4681 -1.9991 H 1 UNL1 0.1547 74 H 9.4157 -0.8192 -1.8820 H 1 UNL1 0.1375 @BOND 1 57 8 1 2 54 44 1 3 72 15 1 4 55 25 1 5 56 25 1 6 24 30 2 7 73 15 1 8 8 37 ar 9 8 38 ar 10 44 38 ar 11 44 45 ar 12 60 40 1 13 74 15 1 14 15 33 1 15 25 37 1 16 25 6 1 17 63 9 1 18 62 12 1 19 58 45 1 20 37 35 ar 21 38 36 ar 22 68 13 1 23 45 34 ar 24 30 39 1 25 30 32 1 26 50 4 1 27 40 39 2 28 40 22 1 29 9 22 ar 30 9 20 ar 31 33 20 1 32 12 61 1 33 12 32 1 34 12 5 1 35 66 13 1 36 52 6 1 37 6 46 1 38 6 42 1 39 13 67 1 40 13 46 1 41 48 2 1 42 39 59 1 43 22 11 ar 44 20 21 ar 45 35 42 1 46 35 7 ar 47 36 7 ar 48 36 43 ar 49 41 5 1 50 41 1 1 51 34 43 ar 52 34 23 2 53 4 5 1 54 4 28 1 55 4 3 1 56 31 46 1 57 31 1 1 58 46 14 1 59 5 51 1 60 27 17 1 61 27 3 1 62 28 18 1 63 7 53 1 64 2 1 1 65 2 3 1 66 2 26 1 67 1 47 1 68 3 49 1 69 11 65 1 70 11 10 ar 71 21 10 ar 72 21 29 1 73 19 29 1 74 16 26 1 75 10 64 1 76 14 71 1 77 14 69 1 78 14 70 1