HMDB0266555 RDKit 3D PA(2:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)) 76 75 0 0 0 0 0 0 0 0999 V2000 11.1613 2.4813 -0.9119 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4608 1.7730 0.2616 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1441 1.3606 -0.2165 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7295 0.1254 -0.2576 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5600 -1.0075 0.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8981 -1.7690 1.3279 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6645 -2.8307 1.7466 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6084 -2.2694 0.8219 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5284 -1.5292 0.9511 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2332 -1.9490 0.4818 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1717 -1.1731 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8753 -1.6156 0.1517 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8156 -0.8531 0.2991 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8488 0.4467 0.9312 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7575 1.1891 1.0541 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5778 0.7298 0.5445 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0765 -0.3073 1.2919 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5183 1.8691 0.4400 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0049 2.3262 1.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5505 1.9574 -0.5897 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6096 0.9659 -0.7721 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2052 -0.3918 -1.2333 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4343 -1.2565 -1.3615 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3044 -2.4520 -1.7186 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6916 -0.7766 -1.0991 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8461 -1.5865 -1.2158 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.8453 -0.9855 -2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2501 0.2953 -1.7399 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1612 1.0559 -2.4484 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5242 2.3910 -1.9036 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6442 0.5962 -3.5158 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4757 -1.6033 0.1806 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8096 -0.3066 0.5744 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4932 -0.2712 2.0980 P 0 0 0 0 0 5 0 0 0 0 0 0 -7.6461 0.6344 2.9687 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5493 -1.8076 2.8051 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0701 0.3063 1.9951 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8079 1.9934 -1.8457 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8625 3.5360 -0.9054 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2628 2.3467 -0.8511 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1516 1.0236 0.6042 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3716 2.5564 1.0796 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4768 2.1779 -0.5614 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7038 -0.0290 -0.6474 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6166 -1.6977 -0.7209 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5817 -0.8074 0.4506 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7082 -1.1076 2.1819 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0354 -3.4933 2.1569 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5461 -3.2238 0.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6197 -0.5493 1.4369 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1130 -2.9065 -0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3497 -0.2313 1.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7451 -2.5781 -0.3388 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8231 -1.1968 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7498 0.8995 1.3418 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7806 2.1577 1.5283 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3999 0.3320 -0.5028 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4632 -0.7326 1.9135 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7774 2.8031 0.2188 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9005 1.6512 2.3913 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0742 2.9873 -0.4502 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0433 2.1745 -1.6153 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4579 1.3578 -1.4261 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1582 0.8693 0.2337 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4662 -0.8766 -0.6455 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8765 -0.2491 -2.3187 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6148 -2.6078 -1.5287 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2785 -0.8030 -3.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6603 -1.6618 -2.4292 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2758 2.2057 -1.1017 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6008 2.8137 -1.4418 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9708 3.0383 -2.6654 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3483 -2.2751 0.1889 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7454 -1.9970 0.9178 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1629 -2.4090 2.3157 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1999 0.7470 1.1166 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 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 29 31 2 0 26 32 1 0 32 33 1 0 33 34 1 0 34 35 2 0 34 36 1 0 34 37 1 0 1 38 1 0 1 39 1 0 1 40 1 0 2 41 1 0 2 42 1 0 3 43 1 0 4 44 1 0 5 45 1 0 5 46 1 0 6 47 1 1 7 48 1 0 8 49 1 0 9 50 1 0 10 51 1 0 11 52 1 0 12 53 1 0 13 54 1 0 14 55 1 0 15 56 1 0 16 57 1 6 17 58 1 0 18 59 1 6 19 60 1 0 20 61 1 0 20 62 1 0 21 63 1 0 21 64 1 0 22 65 1 0 22 66 1 0 26 67 1 6 27 68 1 0 27 69 1 0 30 70 1 0 30 71 1 0 30 72 1 0 32 73 1 0 32 74 1 0 36 75 1 0 37 76 1 0 M END