HMDB0009288 RDKit 3D PE(20:2(11Z,14Z)/18:0) 135134 0 0 0 0 0 0 0 0999 V2000 -14.2385 3.5228 2.3494 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9802 2.9940 1.6979 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2847 2.2476 0.4244 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1894 1.0534 0.6565 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5188 0.0724 1.6077 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4267 -1.0778 1.8009 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1139 -2.3005 1.4874 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8410 -2.7123 0.9037 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1028 -3.7026 1.7308 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8931 -3.4883 2.1983 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1035 -2.2782 1.9927 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8290 -2.5246 1.2009 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1619 -1.1550 1.0962 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9535 -1.2654 0.2577 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9316 -2.2188 0.8063 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7560 -2.2891 -0.1582 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7252 -3.2363 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1162 -2.8106 1.6295 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4444 -1.4458 1.4061 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4704 -1.5623 0.2952 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7935 -1.0873 -0.8415 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2181 -2.1587 0.3841 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -2.2045 -0.7498 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0812 -0.8808 -1.1876 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5175 -0.9045 -2.6693 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5898 0.4534 -3.0214 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9948 0.6639 -4.6597 P 0 0 0 0 0 5 0 0 0 0 0 0 2.1467 -0.6987 -5.2692 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4141 1.5525 -4.8507 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7296 1.5488 -5.3872 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3461 2.5865 -4.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8048 3.3293 -5.1378 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3636 3.8671 -6.4028 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9806 -0.2205 -0.3788 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8904 1.0087 0.2128 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8304 1.6574 0.0219 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9828 1.5854 1.0498 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2513 0.7632 1.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7604 0.6951 -0.3948 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1208 2.0062 -1.0215 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 2.7215 -0.3124 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5098 1.8395 -0.3544 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6422 2.5758 0.3015 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9385 1.7643 0.3249 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3893 1.3827 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6449 0.6023 -1.1484 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9186 1.1964 -0.7563 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1868 1.6423 0.6214 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0604 0.5733 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0548 -0.5391 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0307 -1.6228 2.4315 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7293 -2.3359 2.5827 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2688 -3.0199 1.3381 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9677 4.4506 2.8934 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9728 3.7040 1.5434 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6847 2.8078 3.0633 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3751 3.8900 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3513 2.4220 2.4069 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7699 2.9327 -0.2773 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3165 1.9282 -0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1740 1.3386 1.0192 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3065 0.5381 -0.3197 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4506 0.5574 2.6372 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4997 -0.1423 1.3324 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4271 -0.8352 2.2421 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9109 -3.0537 1.6948 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1054 -3.2889 -0.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1663 -1.9219 0.6077 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6312 -4.6660 1.9468 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4431 -4.2858 2.7954 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5749 -1.4106 1.5627 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7920 -1.9446 3.0436 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1062 -2.8250 0.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1993 -3.2910 1.6323 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8723 -0.3864 0.7652 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8248 -0.8127 2.1177 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5052 -0.2520 0.1516 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2756 -1.6608 -0.7446 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5696 -1.8773 1.7822 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3260 -3.2330 0.9017 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1335 -2.5823 -1.1839 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4237 -1.2402 -0.2808 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9247 -3.3337 -0.4663 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -4.2772 0.4769 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3406 -3.5427 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8692 -2.6663 2.4184 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1852 -0.6688 1.1724 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9053 -1.1187 2.3254 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3954 -2.9671 -0.6231 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0204 -2.6175 -1.6146 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1756 -0.1756 -1.2437 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7152 -1.3900 -3.2206 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5185 -1.3218 -2.7663 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3547 2.4261 -4.3766 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0712 2.0877 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1947 3.2789 -4.4358 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6944 2.6558 -5.2695 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1058 4.2154 -4.5051 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3564 3.1007 -7.1305 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0514 4.5757 -6.7692 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6914 1.6432 2.1393 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1658 2.6238 0.7332 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0242 -0.2746 1.3319 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9755 1.1986 1.7193 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0143 0.2209 -1.0512 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6461 -0.0268 -0.4536 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2511 2.6716 -0.9895 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3731 1.7989 -2.0848 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9745 3.0039 0.6945 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4918 3.6263 -0.8985 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7200 1.5463 -1.4135 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2819 0.9469 0.2569 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4176 2.8169 1.3574 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7915 3.5490 -0.2342 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6908 0.8475 0.9414 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6264 2.3436 0.9421 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5261 0.7918 -1.5023 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4748 2.2553 -1.7267 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5024 -0.4468 -0.7268 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7410 0.3513 -2.2691 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0469 2.1358 -1.4096 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7499 0.4900 -1.0603 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3426 1.8644 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7928 2.5985 0.9436 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0242 0.2282 1.6901 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2643 1.0495 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0600 -0.0752 1.4003 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8837 -0.9272 0.3717 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2557 -1.1435 3.4206 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8173 -2.3602 2.1699 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9350 -1.7038 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9059 -3.1597 3.3351 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1859 -2.3958 0.4506 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2312 -3.4189 1.5512 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8731 -3.9558 1.1559 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 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 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 27 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 24 34 1 0 34 35 1 0 35 36 2 0 35 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 1 54 1 0 1 55 1 0 1 56 1 0 2 57 1 0 2 58 1 0 3 59 1 0 3 60 1 0 4 61 1 0 4 62 1 0 5 63 1 0 5 64 1 0 6 65 1 0 7 66 1 0 8 67 1 0 8 68 1 0 9 69 1 0 10 70 1 0 11 71 1 0 11 72 1 0 12 73 1 0 12 74 1 0 13 75 1 0 13 76 1 0 14 77 1 0 14 78 1 0 15 79 1 0 15 80 1 0 16 81 1 0 16 82 1 0 17 83 1 0 17 84 1 0 18 85 1 0 18 86 1 0 19 87 1 0 19 88 1 0 23 89 1 0 23 90 1 0 24 91 1 6 25 92 1 0 25 93 1 0 29 94 1 0 31 95 1 0 31 96 1 0 32 97 1 0 32 98 1 0 33 99 1 0 33100 1 0 37101 1 0 37102 1 0 38103 1 0 38104 1 0 39105 1 0 39106 1 0 40107 1 0 40108 1 0 41109 1 0 41110 1 0 42111 1 0 42112 1 0 43113 1 0 43114 1 0 44115 1 0 44116 1 0 45117 1 0 45118 1 0 46119 1 0 46120 1 0 47121 1 0 47122 1 0 48123 1 0 48124 1 0 49125 1 0 49126 1 0 50127 1 0 50128 1 0 51129 1 0 51130 1 0 52131 1 0 52132 1 0 53133 1 0 53134 1 0 53135 1 0 M END