HMDB0283953 RDKit 3D PE(PGF2alpha/22:2(13Z,16Z)) 144144 0 0 0 0 0 0 0 0999 V2000 16.2470 3.5049 0.7433 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0527 2.2887 0.2986 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1413 1.1708 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2910 1.6238 -1.2879 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3696 0.4700 -1.7159 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4946 0.0476 -0.6224 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2013 0.1031 -0.6943 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4413 0.5939 -1.8712 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6401 1.7325 -1.4218 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3468 1.7611 -1.4875 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5407 0.6766 -2.0108 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6076 0.1850 -0.8725 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4102 -0.2846 0.2719 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7799 -0.7604 1.5112 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9178 -1.9504 1.5006 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6745 -1.9611 0.7489 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6573 -0.8845 1.1011 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2289 -0.9230 2.4955 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3118 0.0588 3.0637 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9409 0.3322 2.7505 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3397 0.8027 1.5193 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3351 0.0193 0.2936 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0072 0.3015 -0.7469 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5318 -1.1300 0.2455 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3995 -1.9820 -0.8306 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0251 -2.2182 -1.2064 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8036 -1.1436 -1.5671 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2067 -0.0615 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -0.0026 0.3741 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 1.0142 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3647 2.0376 -0.3303 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 1.5343 0.8548 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4418 0.9801 0.3466 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6117 1.4480 0.7203 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9265 0.9363 0.2505 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6436 2.0827 -0.4346 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.8757 2.6033 -1.6129 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4624 1.5876 -2.4722 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9251 3.4177 -2.3311 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1831 2.5669 -2.2000 C 0 0 1 0 0 0 0 0 0 0 0 0 -10.4199 1.8727 -3.3972 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9608 1.6388 -1.0537 C 0 0 2 0 0 0 0 0 0 0 0 0 -11.0302 1.5572 -0.0584 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1802 2.2002 -0.0179 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1565 1.9706 1.1133 C 0 0 1 0 0 0 0 0 0 0 0 0 -13.1264 3.0848 1.9259 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.5517 1.9424 0.4537 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6012 1.7266 1.5002 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9917 1.7453 0.9895 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3787 0.7415 -0.0187 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6988 0.7820 -1.3445 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9659 -3.3550 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2884 -3.3051 -0.0574 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 -4.8830 0.3622 P 0 0 0 0 0 5 0 0 0 0 0 0 4.0873 -5.1205 -0.3646 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9254 -4.9670 2.0275 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6649 -6.0170 -0.1743 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0278 -6.6988 0.8331 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0404 -7.6991 0.2325 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6458 -8.4308 1.2734 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8949 4.1493 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9133 4.0254 -0.1809 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3877 3.2009 1.3808 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7244 2.6014 -0.5001 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6792 1.9761 1.1692 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5963 0.7211 0.6841 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8201 0.3638 -0.5453 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9634 1.8203 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6452 2.4830 -1.0477 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1174 -0.3922 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9466 0.5916 -2.6978 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9028 -0.3483 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5627 -0.2254 0.1525 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8862 -0.2795 -2.2501 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0777 0.9623 -2.7028 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1946 2.5931 -1.0131 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8322 2.6558 -1.1278 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9950 -0.1229 -2.5618 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7964 1.1506 -2.7299 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9368 1.0259 -0.6114 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9868 -0.6251 -1.2853 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1436 0.5379 0.5488 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1484 -1.0868 -0.1146 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2288 0.1514 1.9318 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 -0.8830 2.3387 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8165 -2.4073 2.5411 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5698 -2.7743 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1575 -2.9658 1.0537 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7775 -2.0800 -0.3124 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0517 0.1056 0.8253 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8099 -1.1089 0.4315 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1030 -1.0000 3.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7358 -1.9548 2.7004 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8708 1.0989 2.9584 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3693 -0.0110 4.2339 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2966 -0.6237 3.0341 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5451 1.0011 3.6211 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 1.8309 1.2022 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2522 1.0990 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0129 -1.6272 -1.7058 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4877 -2.8007 -0.3438 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1005 -2.9678 -2.0623 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 1.5503 -2.2182 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0119 0.6201 -1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 2.7962 -0.8407 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4296 2.5715 -0.0038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3657 2.4514 1.4739 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6288 0.8152 1.4911 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4029 0.1651 -0.3551 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6078 2.2768 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7229 0.1030 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5065 0.5257 1.0783 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8455 2.9106 0.2536 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9963 3.2118 -1.3205 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0172 0.7914 -2.4642 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6806 3.6815 -3.3583 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1099 4.3280 -1.7083 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0441 3.2289 -2.0646 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1422 1.2214 -3.2501 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8013 0.6094 -1.4906 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8598 0.8535 0.7953 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4192 2.8920 -0.8072 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9464 1.0610 1.6711 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1947 3.4624 1.9584 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6866 2.8471 -0.1213 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5203 1.0551 -0.2457 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5163 2.5496 2.2657 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4098 0.7481 2.0548 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.2329 2.7684 0.5434 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7279 1.6939 1.8608 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1790 -0.2873 0.4301 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.4972 0.8146 -0.1639 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2423 1.7528 -1.6084 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0348 -0.0926 -1.5234 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.5285 0.6797 -2.1344 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3147 -3.7487 0.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8311 -4.0192 -1.2879 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -4.2059 2.5058 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7651 -7.2822 1.4007 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4561 -6.0657 1.5223 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7331 -7.1910 -0.3842 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6015 -8.3772 -0.4318 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7885 -7.7782 2.0891 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0116 -9.2150 1.5759 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 1 0 13 14 1 0 14 15 1 0 15 16 1 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 2 0 28 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 43 44 2 0 44 45 1 0 45 46 1 0 45 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 25 52 1 0 52 53 1 0 53 54 1 0 54 55 2 0 54 56 1 0 54 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 42 36 1 0 1 61 1 0 1 62 1 0 1 63 1 0 2 64 1 0 2 65 1 0 3 66 1 0 3 67 1 0 4 68 1 0 4 69 1 0 5 70 1 0 5 71 1 0 6 72 1 0 7 73 1 0 8 74 1 0 8 75 1 0 9 76 1 0 10 77 1 0 11 78 1 0 11 79 1 0 12 80 1 0 12 81 1 0 13 82 1 0 13 83 1 0 14 84 1 0 14 85 1 0 15 86 1 0 15 87 1 0 16 88 1 0 16 89 1 0 17 90 1 0 17 91 1 0 18 92 1 0 18 93 1 0 19 94 1 0 19 95 1 0 20 96 1 0 20 97 1 0 21 98 1 0 21 99 1 0 25100 1 6 26101 1 0 26102 1 0 30103 1 0 30104 1 0 31105 1 0 31106 1 0 32107 1 0 32108 1 0 33109 1 0 34110 1 0 35111 1 0 35112 1 0 36113 1 1 37114 1 1 38115 1 0 39116 1 0 39117 1 0 40118 1 1 41119 1 0 42120 1 6 43121 1 0 44122 1 0 45123 1 1 46124 1 0 47125 1 0 47126 1 0 48127 1 0 48128 1 0 49129 1 0 49130 1 0 50131 1 0 50132 1 0 51133 1 0 51134 1 0 51135 1 0 52136 1 0 52137 1 0 56138 1 0 58139 1 0 58140 1 0 59141 1 0 59142 1 0 60143 1 0 60144 1 0 M END