HMDB0262167 RDKit 3D PE(20:4(6Z,8E,10E,14Z)-2OH(5S,12R)/20:3(5Z,8Z,11Z)) 133132 0 0 0 0 0 0 0 0999 V2000 -13.5341 3.9172 -2.6263 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7913 2.9172 -1.6878 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1421 3.7144 -0.6132 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3168 3.0728 0.4037 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8456 2.0809 1.3605 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3835 0.8274 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8479 -0.3428 1.1781 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6926 -0.5888 2.0287 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6125 -1.3149 1.2151 C 0 0 1 0 0 0 0 0 0 0 0 0 -10.0948 -2.5267 0.7418 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1279 -0.4569 0.0789 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9046 -0.7326 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2941 0.0033 -1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0609 -0.3350 -1.9237 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3926 0.3440 -2.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1917 -0.0329 -3.3775 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4198 -1.1401 -2.7856 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1628 -2.0888 -3.8274 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0913 -0.6046 -2.3036 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2778 -1.6611 -1.6435 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9421 -2.8606 -2.4755 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1226 -3.7737 -1.5866 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2381 -4.8947 -2.0131 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2398 -3.4142 -0.3136 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9762 -4.1721 0.6062 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -3.2466 1.8546 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3063 -2.8076 2.2156 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0033 -3.9296 2.6943 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5789 -3.4501 3.0551 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.8719 -2.1376 2.3658 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8032 -3.2226 4.7341 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6565 -4.6502 2.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6761 -4.7809 1.1722 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6428 -5.8608 0.7284 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6822 -6.0159 -0.6938 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -2.1360 1.3489 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0546 -1.8022 1.8531 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5228 -2.5024 2.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8275 -0.6201 1.2907 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9705 -0.0185 0.2094 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6203 1.1488 -0.4835 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9439 2.1857 0.4665 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1312 2.6543 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 2.2176 -0.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3273 1.7190 0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8563 0.5210 0.9037 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5069 -0.5267 -0.0091 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4348 -1.1329 -0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6576 -0.8479 -1.1926 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4727 0.2082 -0.6013 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9770 1.1808 -1.6708 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8174 2.2279 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0978 3.0600 -0.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0075 4.1154 0.6047 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1828 3.5106 1.3151 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0501 4.6276 1.8902 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5495 5.5196 0.7704 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7479 4.4101 -3.2004 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1097 4.6497 -2.0269 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2063 3.3519 -3.2867 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0625 2.4163 -2.3457 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5468 2.1867 -1.3511 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4941 4.5123 -1.1204 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9523 4.3308 -0.1012 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3886 2.5854 -0.0797 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8128 3.9030 1.0048 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6574 2.6059 2.0047 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0697 1.8923 2.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2796 0.7843 0.2242 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3426 -1.2473 0.7422 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9448 -1.3315 2.8605 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2575 0.2801 2.5263 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7307 -1.5285 1.8511 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1893 -2.5494 -0.2437 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6747 0.3327 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3350 -1.5414 0.0527 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7885 0.8132 -1.9771 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6066 -1.1477 -1.4107 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8733 1.1834 -3.5133 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 0.5370 -4.2077 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9457 -1.6451 -2.0047 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9612 -2.1124 -4.4321 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2807 0.2085 -1.5702 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4781 -0.2175 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8592 -2.0525 -0.7531 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3246 -1.2275 -1.2587 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8662 -3.4616 -2.6562 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4019 -2.6483 -3.3968 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0011 -4.3427 0.2089 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5282 -5.1379 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6433 -3.7499 2.6442 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2316 -2.0319 3.0229 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7957 -2.3227 1.3616 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7513 -3.4119 4.9794 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8584 -3.8247 0.6474 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6579 -5.1194 0.8732 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6429 -5.6287 1.1186 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3115 -6.8552 1.1442 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 -6.0583 -1.1126 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0539 -5.3745 -1.2117 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8112 -0.9326 0.9576 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9611 0.0597 2.1565 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8249 -0.8613 -0.5395 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9612 0.2460 0.5914 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4342 0.7187 -1.0844 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8404 1.4906 -1.2485 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0982 2.5846 1.0702 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2882 3.4523 1.3932 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7795 3.1834 -0.4922 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1873 1.6124 -0.9724 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7048 2.4235 1.6408 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5794 0.2809 1.7136 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1216 -1.3928 0.6697 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5201 -0.3088 -0.5621 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0120 -2.0229 -1.5475 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1664 -1.5048 -1.9812 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1323 0.7174 0.2791 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4448 -0.3028 -0.2682 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5500 0.5861 -2.3773 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1278 1.6903 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7548 1.7692 -0.5937 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1764 2.9214 -1.8358 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2651 3.6111 -0.4847 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6659 2.5199 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3981 4.8074 -0.1583 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4299 4.7115 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8786 2.8821 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8477 2.9156 0.6641 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9166 4.1415 2.3842 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5139 5.2199 2.6449 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7778 4.9182 -0.1513 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5018 6.0048 1.0424 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7927 6.2975 0.5554 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 1 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 29 31 1 0 29 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 26 36 1 0 36 37 1 0 37 38 2 0 37 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 2 0 43 44 1 0 44 45 1 0 45 46 2 0 46 47 1 0 47 48 1 0 48 49 2 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 0 3 64 1 0 4 65 1 0 4 66 1 0 5 67 1 0 5 68 1 0 6 69 1 0 7 70 1 0 8 71 1 0 8 72 1 0 9 73 1 1 10 74 1 0 11 75 1 0 12 76 1 0 13 77 1 0 14 78 1 0 15 79 1 0 16 80 1 0 17 81 1 1 18 82 1 0 19 83 1 0 19 84 1 0 20 85 1 0 20 86 1 0 21 87 1 0 21 88 1 0 25 89 1 0 25 90 1 0 26 91 1 1 27 92 1 0 27 93 1 0 31 94 1 0 33 95 1 0 33 96 1 0 34 97 1 0 34 98 1 0 35 99 1 0 35100 1 0 39101 1 0 39102 1 0 40103 1 0 40104 1 0 41105 1 0 41106 1 0 42107 1 0 43108 1 0 44109 1 0 44110 1 0 45111 1 0 46112 1 0 47113 1 0 47114 1 0 48115 1 0 49116 1 0 50117 1 0 50118 1 0 51119 1 0 51120 1 0 52121 1 0 52122 1 0 53123 1 0 53124 1 0 54125 1 0 54126 1 0 55127 1 0 55128 1 0 56129 1 0 56130 1 0 57131 1 0 57132 1 0 57133 1 0 M END