HMDB0241814 RDKit 3D (4Z,7Z,10S,11E)-10-Hydroxy-12-[(1S,2R,3R)-3-hydroxy-5-oxo-2-[(2Z)-pent-2-en-1... 82 82 0 0 0 0 0 0 0 0999 V2000 9.1852 -2.3416 -0.0857 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5437 -2.8010 1.2166 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1280 -3.0478 1.1386 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2114 -2.3873 1.7857 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4832 -1.2769 2.6984 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8435 0.0096 2.2412 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3063 1.0630 3.2806 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3136 1.8518 2.7006 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0997 1.8716 3.5976 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2397 1.6399 2.3361 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7062 2.4675 1.7415 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3966 0.1266 2.2716 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4169 -0.5731 1.5373 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5852 -0.0189 0.6733 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5813 -0.8738 -0.0328 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3754 -2.1065 0.4832 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3254 -0.0256 -0.2798 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1302 0.5630 0.9918 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1921 1.9255 1.1215 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 2.7747 0.0028 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9608 3.6598 -0.5031 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5345 3.5741 -1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2142 3.4736 -2.8129 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8949 2.1870 -3.0796 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9184 1.8299 -2.0242 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9949 2.5426 -1.0412 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6959 0.7469 -2.2435 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7081 0.1933 -1.4749 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9639 0.9855 -2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1060 0.8825 -3.4424 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4014 -0.0082 -4.0779 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9067 1.6328 -4.2395 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.8802 -1.2554 -1.5156 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 -1.8749 -0.7293 N 0 0 0 0 0 4 0 0 0 0 0 0 -7.1926 -1.2899 0.5252 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5212 -3.2911 -0.4519 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1143 -1.9919 -1.5102 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1247 -1.7889 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4441 -3.1578 -0.7659 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5656 -1.5688 -0.5738 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9083 -2.1436 2.0397 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0921 -3.7907 1.4649 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7603 -3.9073 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 -2.6829 1.6379 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5677 -1.0675 2.8925 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0837 -1.4314 3.7507 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2315 0.3020 1.2413 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 0.5191 4.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0236 2.0007 3.4039 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2359 2.9271 3.7498 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5185 1.4555 4.4608 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1572 -0.1930 3.4269 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2708 -1.6446 1.6658 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5954 1.0264 0.4585 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0566 -1.0235 -1.0623 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8016 -2.8706 -0.0149 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4789 0.5866 -1.1398 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4374 -0.8099 -0.6058 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3963 -0.0650 1.8054 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5234 2.3126 2.0604 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 2.3829 -0.8087 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8913 3.5980 0.4412 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2297 4.4806 0.2713 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3909 4.6546 -1.2018 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9152 4.3434 -3.0645 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4478 3.5665 -3.6835 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6245 2.4154 -3.9958 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 1.3508 -3.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6576 0.6597 -0.4452 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7634 2.0385 -1.6886 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8470 0.6400 -1.4715 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8988 -1.7280 -1.1567 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9282 -1.6143 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6477 -1.8362 1.3573 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2821 -1.5285 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1156 -0.2132 0.6246 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7318 -3.6372 -1.1528 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4284 -3.9349 -0.4756 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1222 -3.3131 0.5735 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9567 -1.4106 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9562 -1.6647 -2.5478 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4460 -3.0711 -1.6084 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 3 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 2 3 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 2 3 19 20 1 0 20 21 1 0 21 22 2 3 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 30 32 1 0 28 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 34 37 1 0 12 6 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 0 7 48 1 0 8 49 1 0 9 50 1 0 9 51 1 0 12 52 1 0 13 53 1 0 14 54 1 0 15 55 1 0 16 56 1 0 17 57 1 0 17 58 1 0 18 59 1 0 19 60 1 0 20 61 1 0 20 62 1 0 21 63 1 0 22 64 1 0 23 65 1 0 23 66 1 0 24 67 1 0 24 68 1 0 28 69 1 0 29 70 1 0 29 71 1 0 33 72 1 0 33 73 1 0 35 74 1 0 35 75 1 0 35 76 1 0 36 77 1 0 36 78 1 0 36 79 1 0 37 80 1 0 37 81 1 0 37 82 1 0 M CHG 2 32 -1 34 1 M END