HMDB0265958 RDKit 3D PA(22:4(7Z,10Z,13Z,16Z)/PGF1alpha) 134134 0 0 0 0 0 0 0 0999 V2000 14.9837 5.1035 -1.1759 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1119 4.9135 0.3359 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1343 3.8434 0.6098 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8031 2.5214 0.0126 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4947 1.9983 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6086 1.8600 2.0145 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4741 0.7276 2.6405 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1870 -0.5746 1.9633 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9363 -1.1415 2.4608 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8917 -1.4044 1.7444 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7988 -1.1630 0.2614 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5531 -2.4705 -0.3535 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5153 -2.7521 -1.0657 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3763 -1.9659 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1793 -0.5871 -1.1709 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2121 -0.0995 -0.4272 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2094 -0.9522 0.2016 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7722 -0.6390 -0.2625 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 -1.6016 0.4659 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4489 -1.5274 0.2085 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0572 -1.7494 -1.2263 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5603 -1.6738 -1.3625 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1192 -1.8021 -2.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -1.4855 -0.3448 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -1.4161 -0.2422 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4034 -2.7041 -0.3859 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0230 -3.5473 -1.5307 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6893 -4.8004 -1.3884 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2019 -5.7139 -2.7373 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.0124 -7.1425 -2.3134 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3462 -5.5810 -3.9857 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2566 -5.1179 -3.3546 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8139 -2.5007 -0.2891 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6029 -2.9820 0.7243 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9807 -3.6519 1.6267 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0587 -2.8046 0.8653 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4447 -1.6474 1.7391 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 -0.3687 1.1661 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4963 -0.1306 -0.2171 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9894 -0.0590 -0.2084 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4285 1.0724 0.6824 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9320 1.2169 0.7682 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.2368 2.3693 1.6789 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.0761 3.1301 1.9356 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2483 3.2306 1.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8681 3.0569 -0.4644 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.7648 3.8865 -0.7696 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5049 1.6089 -0.5814 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.6375 0.7267 -0.8887 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8786 1.1242 -1.0811 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9630 0.1442 -1.3900 C 0 0 1 0 0 0 0 0 0 0 0 0 -12.3431 -1.0097 -1.8697 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.7401 -0.2405 -0.1618 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4106 0.9146 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3978 1.6258 -0.3668 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9922 2.7743 0.4521 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6845 2.2443 1.6884 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3817 4.2896 -1.6085 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5391 6.1111 -1.3251 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0263 5.1148 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1344 4.7471 0.8025 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4730 5.9060 0.7089 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2697 3.8116 1.7112 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1352 4.1459 0.1984 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7356 2.6598 -1.1049 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6331 1.8096 0.1609 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7497 2.8346 0.3723 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1039 1.1541 0.0104 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8184 2.7485 2.6496 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5683 0.6677 3.7376 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9944 -1.3280 2.3386 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2730 -0.5659 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8753 -1.3666 3.5488 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0034 -1.8351 2.2451 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7903 -0.8102 -0.0821 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1083 -0.3566 0.0573 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3383 -3.2385 -0.1673 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5231 -3.8374 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4333 -2.6017 -1.2511 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3586 -2.0863 -2.6343 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8387 0.1894 -1.6227 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1420 1.0010 -0.2613 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4094 -2.0187 0.2664 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1763 -0.6285 1.3039 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6860 -0.6624 -1.3467 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4903 0.3888 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2424 -2.6693 0.3189 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0514 -1.4331 1.5713 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9427 -2.2665 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0422 -0.5304 0.5151 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3219 -2.8004 -1.4796 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -1.1080 -1.9326 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0211 -0.7198 -1.0801 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9789 -0.9238 0.7266 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1801 -3.3335 0.5463 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1495 -3.1573 -2.5317 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0535 -3.8543 -1.4008 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1846 -5.9957 -3.6375 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0129 -5.3367 -2.7585 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5576 -2.7523 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5346 -3.7139 1.3351 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9552 -1.8190 2.7248 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5451 -1.6601 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1007 0.4493 1.8632 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8255 -0.4833 1.0463 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0616 0.8465 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1680 -0.9125 -0.8999 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4011 -1.0334 0.1284 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3334 0.0623 -1.2507 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0618 2.0237 0.2005 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0629 0.9651 1.7149 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4070 0.2846 1.1509 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5692 2.0300 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1399 4.0188 1.4945 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2908 2.8613 1.1345 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1474 4.2940 1.2664 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7002 3.3705 -1.0803 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0865 4.6946 -1.2356 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7121 1.5468 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5034 -0.3730 -0.9793 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1901 2.1522 -1.0256 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5761 0.5574 -2.1893 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4190 -1.0605 -2.8693 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4807 -0.9939 -0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0384 -0.6955 0.5615 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7063 1.6369 0.9602 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9927 0.4895 1.3704 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2718 0.9598 -0.6054 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9983 1.9780 -1.3204 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6897 3.3783 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1902 3.4585 0.8061 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9524 2.2115 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.5970 2.8191 1.9487 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0164 1.2079 1.4863 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 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 26 33 1 0 33 34 1 0 34 35 2 0 34 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 46 47 1 0 46 48 1 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 1 0 51 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 48 42 1 0 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 0 3 64 1 0 4 65 1 0 4 66 1 0 5 67 1 0 5 68 1 0 6 69 1 0 7 70 1 0 8 71 1 0 8 72 1 0 9 73 1 0 10 74 1 0 11 75 1 0 11 76 1 0 12 77 1 0 13 78 1 0 14 79 1 0 14 80 1 0 15 81 1 0 16 82 1 0 17 83 1 0 17 84 1 0 18 85 1 0 18 86 1 0 19 87 1 0 19 88 1 0 20 89 1 0 20 90 1 0 21 91 1 0 21 92 1 0 25 93 1 0 25 94 1 0 26 95 1 1 27 96 1 0 27 97 1 0 31 98 1 0 32 99 1 0 36100 1 0 36101 1 0 37102 1 0 37103 1 0 38104 1 0 38105 1 0 39106 1 0 39107 1 0 40108 1 0 40109 1 0 41110 1 0 41111 1 0 42112 1 1 43113 1 1 44114 1 0 45115 1 0 45116 1 0 46117 1 6 47118 1 0 48119 1 6 49120 1 0 50121 1 0 51122 1 6 52123 1 0 53124 1 0 53125 1 0 54126 1 0 54127 1 0 55128 1 0 55129 1 0 56130 1 0 56131 1 0 57132 1 0 57133 1 0 57134 1 0 M END