HMDB0062612 RDKit 3D 17-phenyl-18,19,20-trinor-prostaglandin E2 58 59 0 0 0 0 0 0 0 0999 V2000 6.9071 2.9042 -0.3146 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3009 1.9019 0.3351 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6984 1.7617 0.4006 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3907 0.9300 0.9896 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8202 -0.0942 0.0603 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0008 0.5616 -1.0672 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9137 1.3254 -0.4755 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6645 1.0870 -0.7298 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1997 0.0446 -1.6235 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -0.9903 -0.9315 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0265 -1.6556 0.1733 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8598 -2.5446 0.0853 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6034 -1.0912 1.4848 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2701 -0.4325 1.1821 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1760 0.8145 1.8109 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1043 -0.3587 -0.2851 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1660 -0.8071 -0.8581 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1712 -1.4171 -0.2843 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4205 -1.8149 -1.0202 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4453 -2.1062 -0.1239 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8368 -0.8290 -2.0603 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1126 0.5261 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1872 0.5648 -0.4825 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4966 0.7814 -0.9271 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5442 0.8320 -0.0319 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3599 0.6738 1.3295 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0731 0.4596 1.7761 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0172 0.4089 0.8741 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1280 0.8551 0.5962 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6084 1.4403 1.6008 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0128 0.3784 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6583 -0.6751 -0.3621 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -0.7086 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7164 1.3138 -1.5177 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7673 -0.2453 -1.7432 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2336 2.1370 0.2188 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9036 1.7236 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4604 0.5629 -2.3314 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9045 -0.4200 -2.3024 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0046 -1.7807 -1.6672 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4809 -1.9540 2.1778 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3206 -0.4073 1.9308 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5032 -1.0564 1.6396 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0471 0.7484 2.7636 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1886 0.7523 -0.5519 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3103 -0.6057 -1.9462 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1009 -1.6489 0.7719 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 -2.7632 -1.5428 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1045 -2.4941 0.7121 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7703 -1.1719 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0868 -0.7306 -2.8633 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3659 1.2249 -2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1373 0.8896 -1.0464 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6585 0.9090 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5547 1.0011 -0.3886 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2034 0.7195 2.0034 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8879 0.3286 2.8536 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9955 0.2413 1.2289 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 16 10 1 0 28 23 1 0 3 29 1 0 4 30 1 0 4 31 1 0 5 32 1 0 5 33 1 0 6 34 1 0 6 35 1 0 7 36 1 0 8 37 1 0 9 38 1 0 9 39 1 0 10 40 1 6 13 41 1 0 13 42 1 0 14 43 1 1 15 44 1 0 16 45 1 6 17 46 1 0 18 47 1 0 19 48 1 6 20 49 1 0 21 50 1 0 21 51 1 0 22 52 1 0 22 53 1 0 24 54 1 0 25 55 1 0 26 56 1 0 27 57 1 0 28 58 1 0 M END