HMDB0292499 RDKit 3D CDP-DG(22:5(4Z,7Z,10Z,13Z,16Z)/20:4(6E,8Z,11Z,13E)-2OH(5S,15S)) 159160 0 0 0 0 0 0 0 0999 V2000 -1.4544 5.5099 -3.1151 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6932 4.3844 -4.1236 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6928 3.2676 -3.7779 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8302 2.0945 -4.7276 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2268 1.4717 -4.6484 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 0.3824 -5.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6006 -0.8498 -5.2862 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8302 -1.3653 -3.9006 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2347 -1.8423 -3.8941 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5844 -3.0577 -3.6973 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6676 -4.1935 -3.4485 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0387 -4.7635 -2.1238 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2511 -4.9510 -1.1092 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7985 -4.5973 -1.1697 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1215 -5.9201 -0.9864 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3167 -6.2752 -0.0634 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0819 -5.3713 1.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3209 -5.8626 2.3379 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5229 -6.1826 3.2716 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9755 -6.0946 3.1143 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 -5.1988 4.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1381 -3.8219 4.0512 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5993 -3.4464 2.9909 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2593 -2.8649 5.0453 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8247 -1.5458 4.8154 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -0.7240 3.9220 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0755 0.6800 3.9022 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 1.0275 5.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2541 2.5757 5.3951 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.1928 2.4057 5.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0324 3.4563 6.6111 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3149 3.4545 3.9544 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 4.1318 3.6903 P 0 0 0 0 0 5 0 0 0 0 0 0 2.7316 5.6295 3.8664 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8987 3.4827 4.8401 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4301 3.7183 2.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6564 4.2969 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1489 3.9234 -0.1997 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4827 4.3177 -0.4589 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6293 3.8172 -1.7454 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9798 3.7138 -2.2101 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2359 2.8901 -3.2479 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4966 2.7206 -3.7705 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5725 3.4129 -3.2283 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8894 3.2607 -3.7413 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2890 4.2299 -2.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0354 4.3685 -1.7069 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8010 5.1488 -0.7266 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0214 2.4295 -1.7435 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1061 2.3835 -2.7995 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2917 2.4289 -0.3931 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0868 1.7660 -0.4426 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -1.2124 2.6497 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2148 -1.4312 2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1163 -1.1558 3.0548 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7045 -1.9018 0.9151 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8160 -1.8559 -0.2849 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6115 -2.7021 -0.0738 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6959 -2.7434 -1.2784 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3441 -3.2265 -2.3883 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0144 -1.4642 -1.5496 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0674 -1.0921 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7012 0.1680 -1.1658 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7719 0.5378 -0.5023 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3997 -0.2598 0.5629 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4689 0.4021 1.8445 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5629 0.6359 2.5081 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8572 0.2360 2.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9797 0.4763 2.6856 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3115 0.0751 2.1891 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.5868 -1.2705 2.5268 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4552 0.1795 0.7067 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2352 1.6011 0.2479 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3924 1.6864 -1.2766 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1773 3.1061 -1.7477 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3494 3.1155 -3.2612 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3953 5.8018 -3.0955 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0404 6.3970 -3.4376 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8393 5.1810 -2.1238 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7352 4.0543 -3.9873 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5229 4.7565 -5.1422 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3212 3.6952 -3.8506 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8733 2.9421 -2.7458 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0694 1.3470 -4.4471 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6147 2.4791 -5.7468 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3744 1.1995 -3.6014 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9315 2.3012 -4.9244 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1833 0.6157 -6.7109 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6583 -1.5712 -6.1188 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6437 -0.6142 -3.1343 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0733 -2.1719 -3.7695 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9809 -1.0285 -4.0811 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6906 -3.2513 -3.7236 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6231 -4.0017 -3.5616 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9682 -4.9669 -4.2571 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1062 -5.0717 -1.9574 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6625 -5.3817 -0.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5084 -4.2520 -2.1613 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5263 -3.8425 -0.4526 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3828 -6.6546 -1.7797 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1125 -7.2936 -0.0483 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1531 -5.1478 0.8882 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4121 -4.3682 0.8912 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4062 -5.9669 2.5602 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1559 -6.5496 4.2718 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3602 -5.8535 2.1201 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3498 -7.1613 3.3357 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -5.2198 4.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3378 -5.6723 5.1503 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -1.5455 4.3459 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6466 -1.0079 5.7954 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6822 -0.5699 4.4328 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0655 0.6492 3.4463 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7542 1.4095 3.4578 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 4.3533 6.3064 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8552 3.6924 4.6608 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6387 3.8308 1.2544 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5038 5.3701 1.3003 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5247 4.2941 -1.0271 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0822 4.5153 -2.4102 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3992 2.3359 -3.6864 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6970 2.0473 -4.6146 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9891 3.1095 -4.7678 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7624 3.2888 -3.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7663 1.6276 -1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7563 3.3033 -3.0069 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9575 1.9764 0.3734 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0256 1.0037 0.1756 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7351 -1.4999 0.6713 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 -3.0188 1.0581 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4196 -2.2676 -1.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5688 -0.8111 -0.5897 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9178 -3.7155 0.2137 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0077 -2.2313 0.7464 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -3.4596 -1.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1906 -3.6778 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3675 -0.7882 -2.3095 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3921 -1.7726 -0.1173 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2778 0.8262 -1.9624 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2053 1.4940 -0.7686 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4424 -0.4639 0.1745 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9806 -1.2723 0.7105 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5259 0.7403 2.3057 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5189 1.1614 3.5007 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9853 -0.2613 1.0811 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8984 0.9905 3.6489 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0967 0.6797 2.7101 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7802 -1.8244 1.7353 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7943 -0.5505 0.2075 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5360 -0.0391 0.4573 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2157 1.9082 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9982 2.2369 0.7071 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4249 1.3958 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6492 1.0422 -1.7899 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1997 3.4869 -1.4422 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9542 3.7855 -1.3131 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6615 4.1470 -3.5533 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4044 2.8318 -3.7659 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1408 2.3794 -3.5443 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 2 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 2 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 2 0 33 35 1 0 33 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 42 43 2 0 43 44 1 0 44 45 1 0 44 46 2 0 46 47 1 0 47 48 2 0 40 49 1 0 49 50 1 0 49 51 1 0 51 52 1 0 26 53 1 0 53 54 1 0 54 55 2 0 54 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 59 61 1 0 61 62 2 0 62 63 1 0 63 64 2 0 64 65 1 0 65 66 1 0 66 67 2 0 67 68 1 0 68 69 2 0 69 70 1 0 70 71 1 0 70 72 1 0 72 73 1 0 73 74 1 0 74 75 1 0 75 76 1 0 51 38 1 0 47 41 1 0 1 77 1 0 1 78 1 0 1 79 1 0 2 80 1 0 2 81 1 0 3 82 1 0 3 83 1 0 4 84 1 0 4 85 1 0 5 86 1 0 5 87 1 0 6 88 1 0 7 89 1 0 8 90 1 0 8 91 1 0 9 92 1 0 10 93 1 0 11 94 1 0 11 95 1 0 12 96 1 0 13 97 1 0 14 98 1 0 14 99 1 0 15100 1 0 16101 1 0 17102 1 0 17103 1 0 18104 1 0 19105 1 0 20106 1 0 20107 1 0 21108 1 0 21109 1 0 25110 1 0 25111 1 0 26112 1 1 27113 1 0 27114 1 0 31115 1 0 35116 1 0 37117 1 0 37118 1 0 38119 1 6 40120 1 6 42121 1 0 43122 1 0 45123 1 0 45124 1 0 49125 1 1 50126 1 0 51127 1 1 52128 1 0 56129 1 0 56130 1 0 57131 1 0 57132 1 0 58133 1 0 58134 1 0 59135 1 1 60136 1 0 61137 1 0 62138 1 0 63139 1 0 64140 1 0 65141 1 0 65142 1 0 66143 1 0 67144 1 0 68145 1 0 69146 1 0 70147 1 1 71148 1 0 72149 1 0 72150 1 0 73151 1 0 73152 1 0 74153 1 0 74154 1 0 75155 1 0 75156 1 0 76157 1 0 76158 1 0 76159 1 0 M END