HMDB0286964 RDKit 3D PC(20:0/PGF2alpha) 151151 0 0 0 0 0 0 0 0999 V2000 -4.3139 -1.0768 -3.8404 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9553 -1.5391 -4.3114 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9251 -1.5547 -5.8282 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5859 -2.0125 -6.3628 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4698 -1.1067 -5.9194 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8774 -1.6005 -6.4657 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9751 -0.6383 -5.9985 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3289 -1.0808 -6.4853 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3302 0.0084 -5.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6987 -0.3538 -6.4018 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7817 0.5834 -6.1358 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2456 1.0249 -4.8258 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3296 1.7715 -3.9019 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1298 2.2578 -2.6854 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7477 1.2131 -1.8689 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8389 0.2664 -1.1296 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9834 1.0174 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 0.0962 0.6821 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2854 0.8888 1.6803 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4609 0.0044 2.5102 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0154 -0.5428 3.5124 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -0.3008 2.3206 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4538 -1.1806 3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0094 -1.3606 2.7662 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7736 -2.1829 3.7598 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2327 -3.4572 3.8404 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0008 -4.4729 4.9164 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.1388 -4.6779 6.1649 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1406 -6.0065 4.1779 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.5229 -3.9281 5.3989 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5418 -4.5393 4.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8757 -4.0063 5.1435 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9754 -4.5967 4.4166 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.0297 -3.9859 3.1114 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2386 -4.3064 5.0955 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7831 -6.0293 4.3431 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0036 -1.9187 1.4685 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4545 -1.1958 0.3701 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8626 -0.0522 0.5266 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4431 -1.7927 -0.9982 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8305 -1.5165 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2097 -0.1735 -2.1027 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2351 0.9664 -1.2001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 2.0858 -1.4981 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5813 3.2450 -0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6877 3.8514 -0.1929 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5114 4.3151 -1.4057 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9806 3.2131 -2.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 4.9310 -0.6766 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9222 4.0528 0.5145 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0769 3.2818 0.4097 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6592 3.1375 0.6142 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3457 3.0222 2.0741 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3049 3.5425 2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0985 3.3551 4.1401 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2436 1.9483 4.2744 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1039 4.0655 4.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3154 3.9605 6.0729 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5444 4.6934 7.0588 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9031 4.7474 7.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7115 5.4704 6.1729 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7213 -1.8437 -3.1346 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0248 -0.8953 -4.6705 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2077 -0.1548 -3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -0.7822 -3.9617 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7189 -2.5496 -3.9542 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6978 -2.2281 -6.2341 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -0.5221 -6.1594 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6392 -2.0788 -7.4526 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4298 -3.0466 -5.9823 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6767 -0.0884 -6.3016 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3929 -1.0442 -4.8168 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0757 -2.6159 -6.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8471 -1.5931 -7.5672 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9215 -0.6848 -4.8864 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7269 0.3941 -6.3118 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6175 -2.0665 -6.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 -0.9793 -7.5938 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2099 -0.0052 -4.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9869 0.9585 -6.3966 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6086 -0.5391 -7.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9781 -1.3647 -5.9583 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6992 0.2185 -6.7677 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5566 1.5615 -6.7291 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2040 1.6135 -4.9877 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5711 0.0647 -4.2665 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5306 1.1070 -3.5703 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9642 2.6789 -4.4149 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9287 2.9131 -3.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4897 2.9466 -2.0723 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5352 0.6475 -2.4407 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3574 1.7324 -1.0669 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1956 -0.3254 -1.7804 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4932 -0.4369 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6858 1.6020 0.5047 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3275 1.7442 -0.6865 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 -0.4473 -0.0139 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7909 -0.6239 1.2007 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0159 1.4399 2.3392 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6922 1.6282 1.1092 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9929 -2.1312 3.3347 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4031 -0.6301 4.1939 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4042 -0.3201 2.7684 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8023 -1.6542 4.7466 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8303 -2.3018 3.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 -4.2416 3.6006 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5519 -5.6410 4.7975 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9146 -2.9131 4.9544 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0188 -4.2090 6.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0759 -3.5517 2.7682 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7659 -3.1401 3.0827 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4567 -4.7342 2.3987 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5562 -5.1591 5.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0066 -4.2330 4.3015 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1952 -3.3584 5.6595 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4891 -6.4634 5.3147 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7233 -6.5422 4.0043 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0377 -6.2295 3.5385 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -1.4971 -1.5234 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5154 -2.9004 -0.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7771 -2.1398 -2.6628 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6483 -2.0714 -1.1432 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2691 -0.2946 -2.5823 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6308 0.1496 -3.0437 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7873 0.9240 -0.2715 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0266 2.0633 -2.4621 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2014 3.0040 0.2713 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1738 4.0509 -1.1401 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4211 4.8218 0.3162 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9747 5.0201 -2.0396 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3905 3.4179 -2.9485 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6032 4.9498 -1.3139 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4113 5.9719 -0.4067 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9602 4.7049 1.4288 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 3.3148 -0.5517 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0006 2.1982 0.2011 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0506 2.4581 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4278 4.1222 2.1289 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0084 3.5406 4.6183 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1755 1.8789 4.0101 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0402 3.6908 4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0983 5.1642 4.3063 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1483 2.8287 6.3269 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4446 4.0041 6.3174 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 5.7915 7.0813 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9509 4.3334 8.0983 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3647 3.7061 7.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2077 5.2399 8.2009 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1072 5.7898 5.2867 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1999 6.3890 6.6047 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5446 4.8498 5.7829 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 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 1 0 15 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 26 27 1 0 27 28 2 0 27 29 1 0 27 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 33 36 1 0 24 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 2 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 47 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 53 54 2 0 54 55 1 0 55 56 1 0 55 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 52 46 1 0 1 62 1 0 1 63 1 0 1 64 1 0 2 65 1 0 2 66 1 0 3 67 1 0 3 68 1 0 4 69 1 0 4 70 1 0 5 71 1 0 5 72 1 0 6 73 1 0 6 74 1 0 7 75 1 0 7 76 1 0 8 77 1 0 8 78 1 0 9 79 1 0 9 80 1 0 10 81 1 0 10 82 1 0 11 83 1 0 11 84 1 0 12 85 1 0 12 86 1 0 13 87 1 0 13 88 1 0 14 89 1 0 14 90 1 0 15 91 1 0 15 92 1 0 16 93 1 0 16 94 1 0 17 95 1 0 17 96 1 0 18 97 1 0 18 98 1 0 19 99 1 0 19100 1 0 23101 1 0 23102 1 0 24103 1 6 25104 1 0 25105 1 0 31106 1 0 31107 1 0 32108 1 0 32109 1 0 34110 1 0 34111 1 0 34112 1 0 35113 1 0 35114 1 0 35115 1 0 36116 1 0 36117 1 0 36118 1 0 40119 1 0 40120 1 0 41121 1 0 41122 1 0 42123 1 0 42124 1 0 43125 1 0 44126 1 0 45127 1 0 45128 1 0 46129 1 1 47130 1 6 48131 1 0 49132 1 0 49133 1 0 50134 1 1 51135 1 0 52136 1 6 53137 1 0 54138 1 0 55139 1 1 56140 1 0 57141 1 0 57142 1 0 58143 1 0 58144 1 0 59145 1 0 59146 1 0 60147 1 0 60148 1 0 61149 1 0 61150 1 0 61151 1 0 M CHG 2 29 -1 33 1 M END