HMDB0277903 RDKit 3D PI(20:4(5Z,8Z,11Z,14Z)-OH(20)/22:4(10Z,13Z,16Z,19Z)) 149149 0 0 0 0 0 0 0 0999 V2000 0.7212 5.6833 -6.9065 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8268 5.6065 -6.8956 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2745 6.6622 -5.9656 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9699 6.3832 -4.9066 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3946 5.0226 -4.5073 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7512 4.7741 -3.1847 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3718 4.5882 -2.0583 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8515 4.6131 -1.9851 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4009 3.3665 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 3.4023 -0.3602 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5557 4.6006 0.3993 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9956 4.5058 1.7483 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1624 5.4429 2.2131 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7142 6.6205 1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2686 6.7847 1.2497 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3634 6.9153 2.3882 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2081 5.8403 3.3796 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7491 4.5019 2.8426 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 3.5051 4.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1969 3.9711 5.1117 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2085 3.0189 6.2738 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7079 1.6832 6.0479 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3717 0.8073 6.9353 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5113 1.1939 5.0094 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8763 -0.2058 5.0754 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3499 -0.2977 5.3615 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2611 0.0272 4.4304 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4696 1.0677 3.5748 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6453 1.9939 3.5726 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6456 1.1034 2.6741 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5389 0.4661 1.3681 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5312 1.1022 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6211 0.2840 -0.8229 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6047 -0.2918 -1.3759 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2008 -0.1836 -0.8461 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4384 0.4089 -2.0028 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4212 -0.1331 -2.5623 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1205 -1.4533 -2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5397 -1.1332 -1.7397 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -1.7148 -2.3095 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4273 -2.7398 -3.3381 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -2.3288 -4.6325 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0811 -2.9939 -5.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 -4.1452 -4.4035 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6098 -5.4517 -5.1294 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2234 -5.9340 -5.4557 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3466 -7.2850 -6.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0057 -7.8526 -6.5513 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2309 -9.0835 -7.1984 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5472 -0.8835 3.7753 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -2.2325 3.8353 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5343 -2.9957 2.3822 P 0 0 0 0 0 5 0 0 0 0 0 0 2.7120 -2.8542 1.4377 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2138 -2.2142 1.6856 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1277 -4.6233 2.6025 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9962 -5.2408 3.5025 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1611 -5.8808 4.5841 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5816 -4.8176 5.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9146 -6.7919 5.4914 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0921 -7.8771 5.8246 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2554 -7.2058 4.9793 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2862 -6.3697 5.4226 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 -7.3894 3.4972 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7817 -8.6271 3.1073 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7794 -6.2594 2.7110 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9195 -6.7755 1.7214 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1537 4.9448 -7.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1203 5.4588 -5.8882 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0564 6.6942 -7.1524 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0868 5.9020 -7.9607 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0574 4.5925 -6.6749 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9966 7.7326 -6.1873 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2921 7.1905 -4.2255 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4874 4.9905 -4.5132 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0203 4.2073 -5.1726 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6348 4.7419 -3.1335 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7786 4.3910 -1.1384 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2832 4.9239 -2.9247 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0376 5.4387 -1.2238 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1571 2.4257 -1.9487 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5459 2.4349 0.0257 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7202 4.4363 0.5244 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4381 5.4998 -0.1568 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2451 3.6710 2.3985 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8265 5.2807 3.2349 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3441 6.9074 0.6238 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9724 7.5042 2.2206 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1845 7.7759 0.6658 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8908 6.0605 0.4658 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3208 7.2249 2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6714 7.8738 2.9433 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9296 5.7103 4.1669 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2462 6.1774 3.9788 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5193 4.1423 2.1346 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2218 4.5057 2.3557 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 3.5262 4.4074 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4956 2.4823 3.6648 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2308 4.9390 5.4877 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2501 4.1047 4.7424 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7143 3.5153 7.1682 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8818 2.9911 6.6436 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3705 -0.7153 5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4877 0.3733 6.2857 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5028 -1.3662 5.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8841 2.2073 2.5635 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4927 0.6938 3.3014 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5153 0.3912 0.8159 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2190 -0.6134 1.4898 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9021 2.1327 0.1193 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5641 1.1855 0.8503 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6326 0.1411 -1.3059 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6826 -0.9105 -2.2831 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8995 -1.1670 -0.5416 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1604 0.5805 -0.0666 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8209 1.3805 -2.3562 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0758 0.3679 -3.4187 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -2.2120 -2.8226 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4081 -1.7996 -1.1629 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6572 -0.3669 -0.9661 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5944 -1.4075 -1.9863 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3381 -2.8590 -3.6155 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7156 -3.7422 -2.9959 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6549 -1.4593 -5.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5388 -2.6753 -6.0636 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8037 -3.8908 -4.4035 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4712 -4.2451 -3.3395 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1221 -6.2112 -4.4697 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2025 -5.4476 -6.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7178 -6.1498 -4.4824 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6249 -5.2147 -6.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9527 -7.0859 -7.0791 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8206 -7.9886 -5.4589 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -7.1769 -7.2774 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3632 -8.0251 -5.6668 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3316 -9.8126 -6.5101 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4977 -0.7063 3.4775 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1789 -0.4214 2.9629 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5689 -2.1624 2.2727 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7021 -4.4783 3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3636 -6.4762 4.0732 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0076 -4.3572 4.6231 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0663 -6.2418 6.4702 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4809 -8.1077 5.0779 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4662 -8.2106 5.4308 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9672 -5.7878 6.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4235 -7.4835 3.2437 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7842 -8.6669 2.1172 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6033 -5.6654 2.2088 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4142 -6.7731 0.8497 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 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 1 0 16 17 1 0 17 18 1 0 18 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 2 0 28 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 1 0 36 37 2 0 37 38 1 0 38 39 1 0 39 40 2 0 40 41 1 0 41 42 1 0 42 43 2 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 25 50 1 0 50 51 1 0 51 52 1 0 52 53 2 0 52 54 1 0 52 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 57 59 1 0 59 60 1 0 59 61 1 0 61 62 1 0 61 63 1 0 63 64 1 0 63 65 1 0 65 66 1 0 65 56 1 0 1 67 1 0 1 68 1 0 1 69 1 0 2 70 1 0 2 71 1 0 3 72 1 0 4 73 1 0 5 74 1 0 5 75 1 0 6 76 1 0 7 77 1 0 8 78 1 0 8 79 1 0 9 80 1 0 10 81 1 0 11 82 1 0 11 83 1 0 12 84 1 0 13 85 1 0 14 86 1 0 14 87 1 0 15 88 1 0 15 89 1 0 16 90 1 0 16 91 1 0 17 92 1 0 17 93 1 0 18 94 1 0 18 95 1 0 19 96 1 0 19 97 1 0 20 98 1 0 20 99 1 0 21100 1 0 21101 1 0 25102 1 1 26103 1 0 26104 1 0 30105 1 0 30106 1 0 31107 1 0 31108 1 0 32109 1 0 32110 1 0 33111 1 0 34112 1 0 35113 1 0 35114 1 0 36115 1 0 37116 1 0 38117 1 0 38118 1 0 39119 1 0 40120 1 0 41121 1 0 41122 1 0 42123 1 0 43124 1 0 44125 1 0 44126 1 0 45127 1 0 45128 1 0 46129 1 0 46130 1 0 47131 1 0 47132 1 0 48133 1 0 48134 1 0 49135 1 0 50136 1 0 50137 1 0 54138 1 0 56139 1 1 57140 1 6 58141 1 0 59142 1 1 60143 1 0 61144 1 1 62145 1 0 63146 1 6 64147 1 0 65148 1 6 66149 1 0 M END