HMDB0263095 RDKit 3D PA(20:4(6Z,8E,10E,14Z)-2OH(5S,12R)/14:1(9Z)) 111110 0 0 0 0 0 0 0 0999 V2000 13.1357 3.5269 -1.0028 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4877 3.0802 -1.5256 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5542 1.5625 -1.4889 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3732 1.0614 -0.0538 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4439 -0.4114 -0.0667 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5183 -1.2594 0.3254 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2304 -0.8141 0.8543 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0567 -1.3043 0.0296 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7760 -0.8244 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6490 0.6600 0.7246 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3398 1.0149 1.3741 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1242 0.5148 0.6526 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 0.9572 1.4889 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6386 0.5125 0.8751 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9846 1.3528 0.2074 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1881 -0.7843 1.0364 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9473 -1.1505 0.4359 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1089 -1.7219 1.5277 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8586 -2.0945 1.0671 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0365 -1.1979 0.5315 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2702 0.0088 0.4417 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -1.7311 0.0773 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2486 -0.6220 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -1.1840 -0.8417 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3146 -1.9226 0.2447 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.5014 -2.3865 -0.2637 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3612 -1.2491 1.5321 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2625 -0.3642 1.8251 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3250 0.0709 0.9355 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2191 0.9632 1.2734 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3076 1.4408 0.4319 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1571 2.3430 0.8671 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2962 2.8711 0.0470 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.3596 4.2431 0.3073 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6080 2.2242 0.5282 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7417 2.7065 -0.2365 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5251 1.9253 -0.9677 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2907 0.4957 -1.0558 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2716 -0.4794 -0.5734 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6121 -0.6180 -1.1411 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5057 0.5472 -1.0354 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6701 0.9347 0.4391 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1844 -2.2113 -0.6362 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7612 -3.3042 -0.0393 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0512 -4.5127 -1.1959 P 0 0 0 0 0 5 0 0 0 0 0 0 4.1735 -3.8589 -2.5663 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7633 -5.6004 -1.1443 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5009 -5.2681 -0.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8629 4.5290 -1.4398 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3680 2.8122 -1.4205 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0977 3.5369 0.1023 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3148 3.5397 -0.9589 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5733 3.4451 -2.5649 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7332 1.1420 -2.0922 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5116 1.2166 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2526 1.4609 0.5397 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4347 1.4652 0.2876 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4098 -0.8331 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7871 -2.3209 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0984 -1.3243 1.8556 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2057 0.2476 1.0251 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0699 -2.3893 -0.1118 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1450 -0.8337 -0.9634 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9573 -1.2098 -0.0061 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6141 -1.2652 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7241 1.1043 -0.2896 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4397 1.0924 1.3576 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3705 0.6798 2.4285 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2493 2.1371 1.3966 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1049 -0.5676 0.4873 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9849 0.9965 -0.3357 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9588 2.0807 1.5424 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0133 0.6054 2.5292 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -0.2589 -0.0479 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0736 -1.0149 2.3882 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6206 -2.6512 1.8904 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1332 -2.4728 -0.7094 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8315 -2.3272 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3253 0.2149 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7647 -0.2283 -1.3422 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2036 -0.4138 -1.3234 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -1.9420 -1.6376 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6931 -2.8698 0.4122 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2836 -2.8991 -1.0894 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6002 -1.4873 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2145 0.0936 2.8356 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3921 -0.3417 -0.0493 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1165 1.3733 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4481 1.0714 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0454 2.7344 1.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1439 2.7385 -1.0241 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7792 4.5196 1.0612 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7442 2.6630 1.5853 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5075 1.1625 0.7125 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9656 3.7843 -0.2073 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3398 2.4353 -1.5237 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2180 0.2943 -2.2068 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2550 0.1901 -0.7532 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3366 -0.3719 0.5783 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7518 -1.5115 -0.6256 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1286 -1.5247 -0.6569 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5918 -0.9355 -2.2273 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2084 1.3943 -1.6267 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.5571 0.2801 -1.4207 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1226 0.0976 0.9876 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6696 1.1453 0.8261 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.3134 1.8497 0.4504 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7323 -1.7957 -1.4916 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1831 -2.5025 -1.0088 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0121 -5.3089 -1.7398 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1273 -4.6742 -0.3063 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 2 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 2 0 14 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 25 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 36 37 2 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 17 43 1 0 43 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 45 48 1 0 1 49 1 0 1 50 1 0 1 51 1 0 2 52 1 0 2 53 1 0 3 54 1 0 3 55 1 0 4 56 1 0 4 57 1 0 5 58 1 0 6 59 1 0 7 60 1 0 7 61 1 0 8 62 1 0 8 63 1 0 9 64 1 0 9 65 1 0 10 66 1 0 10 67 1 0 11 68 1 0 11 69 1 0 12 70 1 0 12 71 1 0 13 72 1 0 13 73 1 0 17 74 1 6 18 75 1 0 18 76 1 0 22 77 1 0 22 78 1 0 23 79 1 0 23 80 1 0 24 81 1 0 24 82 1 0 25 83 1 1 26 84 1 0 27 85 1 0 28 86 1 0 29 87 1 0 30 88 1 0 31 89 1 0 32 90 1 0 33 91 1 6 34 92 1 0 35 93 1 0 35 94 1 0 36 95 1 0 37 96 1 0 38 97 1 0 38 98 1 0 39 99 1 0 39100 1 0 40101 1 0 40102 1 0 41103 1 0 41104 1 0 42105 1 0 42106 1 0 42107 1 0 43108 1 0 43109 1 0 47110 1 0 48111 1 0 M END