HMDB0296897 RDKit 3D DG(2:0/0:0/20:4(5E,8Z,12Z,14Z)-OH(11R)) 71 70 0 0 0 0 0 0 0 0999 V2000 -10.5393 -0.9883 -0.2285 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7690 -0.3487 0.8809 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4614 -1.0101 1.1738 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5047 -1.0255 0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1639 0.3998 -0.4416 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2172 0.2734 -1.5623 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9936 0.7550 -1.6094 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4413 1.4944 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2137 1.9700 -0.5449 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2529 1.8554 -1.6299 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0522 3.0556 -2.3036 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8984 1.3851 -1.0375 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1743 0.1010 -0.4209 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9956 -0.1184 0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5092 0.8862 1.7613 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7757 0.4328 2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2635 -0.7385 2.0179 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5324 -1.3206 2.5512 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4829 -1.5251 1.3909 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7743 -0.1627 0.7459 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7064 -0.3485 -0.4084 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4255 -1.1120 -1.3372 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8805 0.3419 -0.4192 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8878 0.3237 -1.3631 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5427 -1.0205 -1.4908 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6586 -1.9986 -1.9158 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1684 -1.4431 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0620 -0.4757 0.3025 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1853 -0.1129 -0.3956 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0615 0.9449 0.2242 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4632 -0.6340 -1.4852 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0788 -1.8875 0.1636 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3187 -0.2440 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9559 -1.2373 -1.1216 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6891 0.7482 0.7208 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4019 -0.4721 1.8088 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6514 -2.0420 1.4778 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9911 -0.4950 2.0385 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5489 -1.4718 0.3598 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8935 -1.6165 -0.8309 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1191 0.8992 -0.7678 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7964 0.9842 0.3905 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5217 -0.2735 -2.4767 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3993 0.5825 -2.5251 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0351 1.6645 0.3874 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8721 2.5226 0.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5823 1.1209 -2.3759 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4489 3.0354 -3.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2774 1.2086 -1.9727 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3856 2.1497 -0.4925 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5513 -0.6863 -1.1156 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2366 -1.1239 1.2413 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2283 0.8852 2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4917 1.9256 1.4585 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 1.0246 3.1058 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7524 -1.3618 1.2851 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3016 -2.2865 3.0316 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9813 -0.6012 3.2715 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0924 -2.2427 0.6669 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4505 -1.8599 1.8483 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8386 0.2744 0.3643 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2155 0.5219 1.4674 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4312 0.6244 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6800 1.0946 -1.1008 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3384 -0.9351 -2.2896 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6596 -2.7851 -1.2957 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3589 -1.6078 0.5652 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6834 -2.4205 -0.2827 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3770 1.7952 0.4375 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8260 1.2213 -0.5289 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4925 0.5158 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 29 31 2 0 1 32 1 0 1 33 1 0 1 34 1 0 2 35 1 0 2 36 1 0 3 37 1 0 3 38 1 0 4 39 1 0 4 40 1 0 5 41 1 0 5 42 1 0 6 43 1 0 7 44 1 0 8 45 1 0 9 46 1 0 10 47 1 6 11 48 1 0 12 49 1 0 12 50 1 0 13 51 1 0 14 52 1 0 15 53 1 0 15 54 1 0 16 55 1 0 17 56 1 0 18 57 1 0 18 58 1 0 19 59 1 0 19 60 1 0 20 61 1 0 20 62 1 0 24 63 1 0 24 64 1 0 25 65 1 6 26 66 1 0 27 67 1 0 27 68 1 0 30 69 1 0 30 70 1 0 30 71 1 0 M END