HMDB0295837 RDKit 3D DG(18:0/0:0/20:4(5Z,8Z,11Z,14Z)-OH(18R)) 119118 0 0 0 0 0 0 0 0999 V2000 -10.3790 -1.0157 1.9244 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4452 -2.0728 1.8433 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8198 -1.5207 1.7384 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1949 -0.6753 0.5888 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1772 -1.2259 -0.7736 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9355 -1.6610 -1.4189 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9064 -0.5352 -1.6382 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4880 0.5249 -2.5092 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5847 1.6278 -2.8579 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9843 2.5346 -1.8849 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0465 2.0744 -0.8537 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8126 1.3721 -1.4403 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0463 2.2805 -2.3217 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8751 1.8001 -3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7045 1.2243 -2.3775 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8253 -0.0476 -1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4339 -0.3572 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0322 0.7292 -0.1246 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2914 1.6568 -0.5129 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5032 0.6828 1.1609 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2178 1.6422 2.1312 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 1.6913 2.3795 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5631 2.6986 3.3703 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2884 0.3515 2.9858 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0258 0.4865 3.4473 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1272 0.7999 2.6689 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9673 0.9693 1.4441 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4733 0.9338 3.2874 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5388 1.2317 2.3132 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8409 0.1932 1.2733 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2713 -1.0753 1.8989 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4656 -1.5834 1.7222 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4750 -0.9160 0.8828 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9614 -1.6994 -0.2574 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1970 -2.0762 -0.4945 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2872 -1.7364 0.4199 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0597 -2.9074 0.8824 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3175 -3.0497 0.6221 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1875 -2.1762 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7793 -0.9766 -0.7747 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2397 0.2259 -0.5249 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2570 0.6401 0.4439 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4011 1.3884 -0.1791 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1569 0.5913 -1.1944 C 0 0 1 0 0 0 0 0 0 0 0 0 16.1795 1.4001 -1.7482 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8610 -0.6293 -0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5939 -1.3403 -1.7158 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8735 -0.9704 2.9089 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7846 0.0112 1.7529 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5856 -1.2449 1.1832 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2057 -2.9198 1.1812 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4236 -2.5730 2.8848 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9422 -0.8524 2.6624 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5558 -2.3669 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2558 -0.3278 0.7866 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5758 0.2726 0.6783 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7456 -0.5767 -1.5062 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8534 -2.1522 -0.7425 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2161 -1.9401 -2.4897 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4057 -2.5240 -1.0463 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0299 -1.0211 -2.1018 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6228 -0.0997 -0.6962 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4781 0.8912 -2.0961 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8108 0.0385 -3.4861 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7443 1.1414 -3.4844 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1591 2.2825 -3.6007 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8643 3.0130 -1.3084 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5767 3.4845 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4245 1.5084 -0.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5518 3.0427 -0.4207 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1800 1.2305 -0.5018 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0290 0.3706 -1.8194 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7638 2.7418 -3.0848 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7295 3.2240 -1.7424 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2342 1.0235 -3.8284 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4551 2.6427 -3.7209 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9268 1.0364 -3.1976 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2073 2.0271 -1.7574 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9516 -0.8655 -2.4202 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5770 -0.1808 -0.8916 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5218 -1.3014 -0.4762 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7018 -0.5134 -1.8481 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7176 1.3903 3.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5609 2.6578 1.7793 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1424 1.9685 1.4932 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2905 2.2376 4.1907 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2837 -0.3955 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9885 0.0087 3.7447 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4617 1.7957 4.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6977 0.0546 3.9429 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4712 1.5615 2.8282 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2063 2.1475 1.7338 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4407 0.5431 0.4554 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8398 -0.0820 0.7583 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5226 -1.6015 2.5472 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7023 -2.5461 2.2283 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1409 0.1020 0.5058 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3078 -0.6315 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2044 -2.0142 -1.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3784 -2.6642 -1.4194 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7894 -0.7938 0.2933 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7080 -1.4979 1.4343 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5633 -3.7112 1.4794 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8194 -3.9894 1.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7686 -2.8637 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0734 -1.8977 0.5655 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0220 -1.0581 -1.5882 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8047 1.0414 -1.1231 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7389 1.4112 1.1084 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6777 -0.1277 1.0874 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0167 2.2958 -0.7207 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1203 1.6875 0.6188 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4625 0.2204 -1.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6463 0.8322 -2.4059 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5513 -0.3191 0.2199 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1675 -1.3610 -0.1664 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6623 -2.4124 -1.4812 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6022 -0.8557 -1.7788 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9922 -1.1592 -2.6299 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 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 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 1 0 34 35 2 0 35 36 1 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 1 0 40 41 2 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 1 48 1 0 1 49 1 0 1 50 1 0 2 51 1 0 2 52 1 0 3 53 1 0 3 54 1 0 4 55 1 0 4 56 1 0 5 57 1 0 5 58 1 0 6 59 1 0 6 60 1 0 7 61 1 0 7 62 1 0 8 63 1 0 8 64 1 0 9 65 1 0 9 66 1 0 10 67 1 0 10 68 1 0 11 69 1 0 11 70 1 0 12 71 1 0 12 72 1 0 13 73 1 0 13 74 1 0 14 75 1 0 14 76 1 0 15 77 1 0 15 78 1 0 16 79 1 0 16 80 1 0 17 81 1 0 17 82 1 0 21 83 1 0 21 84 1 0 22 85 1 6 23 86 1 0 24 87 1 0 24 88 1 0 28 89 1 0 28 90 1 0 29 91 1 0 29 92 1 0 30 93 1 0 30 94 1 0 31 95 1 0 32 96 1 0 33 97 1 0 33 98 1 0 34 99 1 0 35100 1 0 36101 1 0 36102 1 0 37103 1 0 38104 1 0 39105 1 0 39106 1 0 40107 1 0 41108 1 0 42109 1 0 42110 1 0 43111 1 0 43112 1 0 44113 1 6 45114 1 0 46115 1 0 46116 1 0 47117 1 0 47118 1 0 47119 1 0 M END