HMDB0013032 RDKit 3D Omega-Carboxy-trinor-leukotriene B4 50 49 0 0 0 0 0 0 0 0999 V2000 -6.6260 3.3398 1.5589 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3827 2.1387 1.7249 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7586 1.6975 2.8854 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7429 1.1265 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6099 1.1821 -0.3506 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8371 0.2355 -1.4138 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0903 -0.7366 -1.7889 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8341 -1.2167 -1.3349 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 -0.6241 -0.3128 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4772 0.6501 -0.5709 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 -1.5761 -0.1178 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5813 -1.1599 0.0548 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4755 -2.1532 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -1.8162 0.4142 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8024 -2.7870 0.5925 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0588 -2.4662 0.7724 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 -1.0634 0.8080 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7901 -0.3000 1.7032 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6291 -0.4595 -0.5652 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0781 0.9616 -0.4746 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4056 1.1056 0.1869 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7962 2.5469 0.2423 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8953 2.8557 0.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0072 3.5697 -0.2548 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7786 1.9216 3.0767 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6877 1.3548 0.1947 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8175 0.1549 1.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6974 1.2564 0.1794 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7803 2.2193 -0.8074 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8270 0.4004 -1.9828 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5486 -1.3322 -2.6801 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8738 -2.3444 -1.0775 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1661 -1.3089 -2.2941 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4240 -0.5955 0.7149 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7836 1.0204 -1.4285 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0107 -2.6333 -0.1262 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3624 -0.1028 0.0648 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2654 -3.2144 0.2244 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9669 -0.7712 0.4257 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5383 -3.8679 0.5766 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7813 -3.2978 0.8958 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5631 -1.0971 1.2086 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0539 0.6267 1.7982 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4140 -1.0512 -1.1138 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7008 -0.4806 -1.1564 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1652 1.3542 -1.5233 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2734 1.5553 0.0133 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3610 0.7557 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1545 0.5516 -0.4115 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0658 3.8753 -1.2264 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 2 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 6 30 1 0 7 31 1 0 8 32 1 0 8 33 1 0 9 34 1 1 10 35 1 0 11 36 1 0 12 37 1 0 13 38 1 0 14 39 1 0 15 40 1 0 16 41 1 0 17 42 1 1 18 43 1 0 19 44 1 0 19 45 1 0 20 46 1 0 20 47 1 0 21 48 1 0 21 49 1 0 24 50 1 0 M END