HMDB0289213 RDKit 3D PC(DiMe(9,3)/20:3(5Z,8Z,11Z)-O(14R,15S)) 136137 0 0 0 0 0 0 0 0999 V2000 -5.5861 0.2184 7.9479 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2411 0.0160 8.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 -0.4337 7.5589 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0291 0.5751 6.4541 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9772 0.0487 5.4998 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3956 -1.2804 4.9179 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5565 -1.4064 4.1832 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -1.3797 3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -2.6800 2.8563 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -2.5430 1.4044 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8658 -2.6189 0.6345 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5257 -2.8563 1.0931 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0235 -4.0423 0.4403 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4511 -5.0997 1.0586 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4917 -5.2503 2.4673 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7247 -5.4478 3.2177 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9351 -5.4404 2.8305 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 -5.2111 1.4702 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4054 -4.0087 1.6547 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1467 -3.5816 0.4663 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4481 -3.0939 -0.7138 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2230 -2.5608 -1.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1136 -3.1062 -1.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7265 -2.5275 -2.2879 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6100 -1.5794 -2.0423 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0457 -0.5850 -1.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1326 0.3869 -0.6839 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9706 0.3264 -1.1555 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5933 1.4060 0.2841 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4216 2.2744 0.7045 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8795 3.3177 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5858 4.1038 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9517 5.1520 2.9947 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1068 5.9446 3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0788 6.7493 2.9194 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1737 6.3118 2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0511 5.5843 0.8501 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3208 4.2864 0.6953 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 3.9547 -0.5548 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2834 2.6024 -1.1403 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5407 2.5020 -1.9633 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6808 1.1091 -2.5392 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6712 5.0519 -1.2836 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 5.1730 -2.7121 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6423 6.0875 -0.3737 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2486 7.4926 -0.6385 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2064 -3.7007 -3.1397 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8078 -3.2159 -4.3891 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2199 -4.4045 -5.4035 P 0 0 0 0 0 5 0 0 0 0 0 0 1.5104 -5.4879 -4.6506 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5264 -5.1222 -6.2097 O 0 0 0 0 0 1 0 0 0 0 0 0 1.2031 -3.6810 -6.5488 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8096 -2.5291 -7.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9491 -1.8484 -8.0814 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3221 -1.4211 -7.5752 N 0 0 0 0 0 4 0 0 0 0 0 0 -0.2392 -0.5012 -6.4719 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -0.6861 -8.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2007 -2.5236 -7.2271 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2674 0.5953 8.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5576 1.0085 7.1521 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0259 -0.7240 7.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 -0.6728 9.4067 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9204 1.0121 8.9814 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5501 -1.4021 7.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2299 -0.6024 8.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6338 1.5343 6.8475 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9489 0.7592 5.8906 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8063 0.7768 4.6973 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0105 -0.0985 6.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1427 -2.2004 5.4884 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2533 -0.4580 2.8479 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9124 -3.0033 3.3042 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6112 -3.4602 3.1354 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8709 -2.3653 0.9253 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9703 -2.5057 -0.4606 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1085 -1.9800 0.6425 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -2.7498 2.1597 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0122 -4.0221 -0.6717 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7874 -5.9639 0.4292 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9121 -6.2430 2.6718 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7962 -4.5535 3.0361 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5765 -5.6431 4.3468 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 -5.6344 3.6285 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7656 -4.8836 0.7105 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1394 -6.0334 1.1343 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8208 -3.1581 2.1155 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1488 -4.2636 2.4553 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9336 -2.8408 0.8157 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7687 -4.4801 0.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5814 -2.0976 -2.8394 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3217 -1.0127 -2.9784 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7246 -2.0756 -1.6695 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3047 2.0615 -0.2385 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0188 0.9216 1.1734 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9335 2.6974 -0.1717 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6801 1.5737 1.1775 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3363 2.8796 2.5902 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 3.9724 1.2005 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3342 4.5833 1.0407 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1501 3.3996 2.3883 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7026 5.8815 2.4846 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6566 4.7084 3.7826 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4653 6.6218 4.3922 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6478 5.2793 4.4282 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4936 7.6209 2.4196 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5923 7.3935 3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8251 7.2672 1.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9153 5.7661 2.7984 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3879 2.2680 -1.7084 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4013 1.8546 -0.3067 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3988 2.7703 -1.3147 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5643 3.2013 -2.8228 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1956 0.4192 -1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6393 0.7618 -2.7788 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2214 1.1128 -3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9011 5.9863 -3.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4696 4.2660 -3.2909 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2095 5.3871 -2.7432 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7457 8.2118 0.0374 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1418 7.5709 -0.6271 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5629 7.7914 -1.6741 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3698 -4.1588 -2.6114 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0118 -4.4136 -3.3149 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7398 -2.8743 -7.6072 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1593 -1.8986 -6.2482 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7535 -2.5719 -8.8974 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4734 -0.9697 -8.4781 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3076 0.5579 -6.8134 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6222 -0.6350 -5.8171 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1524 -0.6578 -5.8376 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6596 -1.1237 -9.6298 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0671 -0.7838 -8.5126 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 0.3942 -8.6307 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2467 -2.1333 -7.3176 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0114 -3.3945 -7.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0234 -2.7610 -6.1619 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 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 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 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 39 43 2 0 43 44 1 0 43 45 1 0 45 46 1 0 24 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 49 51 1 0 49 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 55 57 1 0 55 58 1 0 8 6 1 0 45 37 2 0 1 59 1 0 1 60 1 0 1 61 1 0 2 62 1 0 2 63 1 0 3 64 1 0 3 65 1 0 4 66 1 0 4 67 1 0 5 68 1 0 5 69 1 0 6 70 1 0 8 71 1 0 9 72 1 0 9 73 1 0 10 74 1 0 11 75 1 0 12 76 1 0 12 77 1 0 13 78 1 0 14 79 1 0 15 80 1 0 15 81 1 0 16 82 1 0 17 83 1 0 18 84 1 0 18 85 1 0 19 86 1 0 19 87 1 0 20 88 1 0 20 89 1 0 24 90 1 6 25 91 1 0 25 92 1 0 29 93 1 0 29 94 1 0 30 95 1 0 30 96 1 0 31 97 1 0 31 98 1 0 32 99 1 0 32100 1 0 33101 1 0 33102 1 0 34103 1 0 34104 1 0 35105 1 0 35106 1 0 36107 1 0 36108 1 0 40109 1 0 40110 1 0 41111 1 0 41112 1 0 42113 1 0 42114 1 0 42115 1 0 44116 1 0 44117 1 0 44118 1 0 46119 1 0 46120 1 0 46121 1 0 47122 1 0 47123 1 0 53124 1 0 53125 1 0 54126 1 0 54127 1 0 56128 1 0 56129 1 0 56130 1 0 57131 1 0 57132 1 0 57133 1 0 58134 1 0 58135 1 0 58136 1 0 M CHG 2 51 -1 55 1 M END