HMDB0041550 RDKit 3D Oleoside 11-methyl ester 52 53 0 0 0 0 0 0 0 0999 V2000 -0.1678 -2.2046 -2.1229 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1224 -1.7737 -1.5371 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3808 -0.5700 -1.1103 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 0.4905 -1.1831 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8149 0.2571 -0.5252 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9745 0.5889 -1.1366 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -0.5310 -1.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2341 -1.0720 -0.1055 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1754 -2.2201 -0.4911 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5283 -3.1906 -1.2377 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -0.1244 0.7231 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3647 -0.7618 1.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2465 1.1160 0.9585 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1669 0.7314 1.7474 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8101 1.6112 -0.4002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2122 2.8370 -0.2795 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9233 1.6268 -0.4672 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6242 1.3505 0.6919 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5584 0.3820 0.7117 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2726 0.0995 1.9118 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 -0.7947 2.0138 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0421 0.8310 3.0958 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7539 0.5472 4.2866 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7804 -0.3220 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4699 0.5927 -1.5409 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8236 0.9623 -1.2282 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4782 0.5853 -0.2521 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4819 1.8397 -2.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0422 -3.0360 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -2.6311 -1.3517 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6429 -1.4212 -2.7446 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8992 -2.5372 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2101 0.9208 -2.1958 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8477 1.0158 -2.1642 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4499 -1.4613 0.5509 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0300 -1.8387 -1.0867 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6339 -2.6773 0.4225 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3311 -3.9484 -0.6464 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0163 0.1572 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6448 -0.0445 2.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8458 1.9144 1.4255 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7752 1.5834 2.1023 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7369 1.7421 -0.9989 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9342 3.2470 -1.1129 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4387 1.9105 1.6192 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3803 -0.3961 4.7573 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6452 1.4157 4.9541 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8138 0.3828 3.9793 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2786 -1.2865 -0.4481 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4845 0.0553 -2.5348 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7979 1.4723 -1.7151 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0851 2.5768 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 8 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 4 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 19 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 24 3 1 0 15 6 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 4 33 1 0 6 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 10 38 1 0 11 39 1 0 12 40 1 0 13 41 1 0 14 42 1 0 15 43 1 0 16 44 1 0 18 45 1 0 23 46 1 0 23 47 1 0 23 48 1 0 24 49 1 0 25 50 1 0 25 51 1 0 28 52 1 0 M END