HMDB0288470 RDKit 3D PC(22:5(7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,11E,13Z,15E,19Z)-2OH(10S,17)) 146145 0 0 0 0 0 0 0 0999 V2000 -6.8884 -5.9924 6.6953 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1473 -7.1039 5.9047 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0536 -6.5859 4.5233 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9518 -6.3770 3.8496 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6079 -6.6377 4.3823 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8301 -7.5784 3.5735 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -7.2358 2.9955 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -5.8730 3.1147 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1576 -5.9441 3.7519 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -5.5503 3.1944 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3462 -4.9854 1.8494 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3603 -5.7730 1.1198 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3654 -6.4667 0.0563 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2512 -6.7181 -0.8516 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0643 -6.2243 -0.5493 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7562 -5.3631 -1.2535 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2766 -4.7471 -2.5001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1887 -5.1355 -3.6424 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8331 -4.5255 -4.9565 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9167 -3.0152 -4.9361 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5609 -2.5163 -6.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6595 -1.0596 -6.4291 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7528 -0.5254 -7.5601 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6577 -0.2437 -5.3144 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7865 1.1592 -5.4653 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7009 1.8646 -4.1119 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0584 3.3196 -4.2451 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0131 3.9268 -3.0014 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4188 5.5727 -3.1116 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.9192 5.7461 -3.1799 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7805 6.4062 -1.8018 O 0 0 0 0 0 1 0 0 0 0 0 0 -0.6876 6.1852 -4.5301 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6466 6.5316 -4.2624 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2393 7.0686 -5.5251 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6057 7.4774 -5.4361 N 0 0 0 0 0 4 0 0 0 0 0 0 3.5262 6.4277 -5.0943 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7982 8.6184 -4.5589 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9892 7.9457 -6.7753 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5709 1.6669 -3.5923 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9634 0.9464 -2.4946 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0852 0.3572 -1.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4387 0.8962 -2.1354 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 2.0465 -2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5868 2.0966 -2.6351 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1951 3.1239 -2.0852 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5283 4.3682 -1.6196 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7675 4.6315 -0.1963 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7972 4.6757 0.6791 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 4.4773 0.4143 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9626 3.2699 1.2793 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1915 3.5433 2.6167 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5649 2.8692 1.0106 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0673 1.8466 1.7232 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2908 1.3763 1.5371 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7789 0.3825 2.2242 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9921 -0.3142 3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5362 -1.3223 3.8904 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8351 -2.1125 4.9283 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3241 -2.6388 4.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4824 -1.3064 6.1634 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7319 -0.7921 6.7392 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0669 0.4525 6.9316 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1752 1.5714 6.5726 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8334 2.4013 7.8245 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2965 -5.0356 6.6016 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9169 -6.2229 7.7632 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8641 -5.7718 6.2383 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2389 -7.2680 6.4516 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8262 -7.9840 5.9777 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9878 -6.3342 3.9625 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0069 -5.9885 2.8372 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0987 -5.7624 4.7968 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8012 -7.2515 5.3531 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -8.6181 3.4288 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1218 -7.9540 2.3818 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1754 -5.4360 2.0937 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8098 -5.2018 3.7488 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2407 -6.3604 4.7758 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2199 -5.6231 3.7375 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8503 -3.9476 1.9626 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4441 -4.7581 1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -5.7414 1.6571 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3614 -6.9579 -0.2305 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6238 -6.4304 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -7.8717 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5517 -6.6549 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7586 -5.1021 -0.8606 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4259 -3.6263 -2.3931 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7739 -4.8635 -2.7345 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1037 -6.2519 -3.7679 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2544 -4.9698 -3.3962 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5434 -4.8963 -5.7054 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1731 -4.8322 -5.2877 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9976 -2.7438 -4.7747 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3308 -2.5489 -4.1465 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4904 -2.8149 -6.5718 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2076 -3.0702 -7.0415 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0468 1.5916 -6.1553 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 1.3269 -5.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4534 1.3413 -3.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0648 3.4536 -4.7261 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3136 3.7955 -4.9321 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6682 7.2693 -3.4367 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 5.6093 -3.8818 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6431 7.9660 -5.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1633 6.2970 -6.3226 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3924 6.9092 -4.5671 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0734 5.7171 -4.3999 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8869 5.8972 -5.9963 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8908 8.6539 -4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 8.5434 -3.6095 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5659 9.5720 -5.1049 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6242 7.1878 -7.5085 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6158 8.9544 -6.9776 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0954 7.9201 -6.8176 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 0.9999 -1.0548 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7944 -0.0860 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0221 1.8204 -3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5757 2.9381 -2.5971 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1587 1.2033 -2.9502 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2824 3.0857 -1.9464 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0778 5.1896 -2.2138 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 4.4978 -1.9252 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7869 4.8013 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0258 4.8871 1.7566 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7315 5.3140 0.8056 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0626 4.2553 -0.5915 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5938 2.3843 0.9823 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3908 4.0365 2.9781 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0833 3.3305 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7538 1.4157 2.4335 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9135 1.8737 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8201 0.1017 2.0054 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0221 -0.0793 3.4652 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5807 -1.5544 3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4586 -3.0027 5.2038 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0317 -2.6954 5.0509 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0063 -2.0664 6.8579 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2283 -0.5495 5.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4763 -1.5655 7.0434 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0673 0.7003 7.3851 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2434 1.2343 6.1644 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7311 2.2586 5.8725 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7302 2.4246 8.4997 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6133 3.4198 7.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0402 1.9304 8.3343 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 2 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 1 0 29 30 2 0 29 31 1 0 29 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 35 38 1 0 26 39 1 0 39 40 1 0 40 41 2 0 40 42 1 0 42 43 1 0 43 44 1 0 44 45 2 0 45 46 1 0 46 47 1 0 47 48 2 0 48 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 52 53 2 0 53 54 1 0 54 55 2 0 55 56 1 0 56 57 2 0 57 58 1 0 58 59 1 0 58 60 1 0 60 61 1 0 61 62 2 0 62 63 1 0 63 64 1 0 1 65 1 0 1 66 1 0 1 67 1 0 2 68 1 0 2 69 1 0 3 70 1 0 4 71 1 0 5 72 1 0 5 73 1 0 6 74 1 0 7 75 1 0 8 76 1 0 8 77 1 0 9 78 1 0 10 79 1 0 11 80 1 0 11 81 1 0 12 82 1 0 13 83 1 0 14 84 1 0 14 85 1 0 15 86 1 0 16 87 1 0 17 88 1 0 17 89 1 0 18 90 1 0 18 91 1 0 19 92 1 0 19 93 1 0 20 94 1 0 20 95 1 0 21 96 1 0 21 97 1 0 25 98 1 0 25 99 1 0 26100 1 1 27101 1 0 27102 1 0 33103 1 0 33104 1 0 34105 1 0 34106 1 0 36107 1 0 36108 1 0 36109 1 0 37110 1 0 37111 1 0 37112 1 0 38113 1 0 38114 1 0 38115 1 0 42116 1 0 42117 1 0 43118 1 0 43119 1 0 44120 1 0 45121 1 0 46122 1 0 46123 1 0 47124 1 0 48125 1 0 49126 1 0 49127 1 0 50128 1 6 51129 1 0 52130 1 0 53131 1 0 54132 1 0 55133 1 0 56134 1 0 57135 1 0 58136 1 1 59137 1 0 60138 1 0 60139 1 0 61140 1 0 62141 1 0 63142 1 0 63143 1 0 64144 1 0 64145 1 0 64146 1 0 M CHG 2 31 -1 35 1 M END