HMDB0284772 RDKit 3D PE(DiMe(11,5)/20:4(5Z,8Z,10E,14Z)-OH(12S)) 139139 0 0 0 0 0 0 0 0999 V2000 15.8464 1.3418 -0.4471 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3946 2.8122 -0.6297 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7006 3.2472 -2.0424 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3603 4.6367 -2.3184 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9657 5.1395 -2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3051 5.0123 -0.9646 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1835 4.4070 -0.7159 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3941 3.7343 -1.7718 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2964 2.2600 -1.4464 C 0 0 2 0 0 0 0 0 0 0 0 0 10.5193 1.6382 -2.4037 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9410 1.9383 -0.0799 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7433 1.5758 0.3664 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 1.2759 1.7577 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4119 0.9304 2.3183 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1235 0.7559 1.7283 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8520 1.0331 0.3578 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4491 0.1577 -0.5931 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2450 -1.2480 -0.2965 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8761 -1.7808 -0.4288 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2013 -1.6793 -1.7541 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8393 -2.3459 -1.6185 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5166 -3.2543 -2.4158 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9532 -1.9770 -0.6295 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7197 -2.5225 -0.3894 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4851 -1.6062 -0.5288 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6005 -2.3714 -0.2067 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9241 -2.0219 -0.1612 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2635 -0.8728 -0.4371 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8583 -3.1326 0.2395 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3889 -3.0480 1.5934 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3801 -2.0161 1.9445 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7344 -2.1410 1.4143 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0768 -2.0336 0.0145 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8701 -0.6373 -0.5767 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2227 -0.7521 -2.0478 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1916 0.5959 -2.7013 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2240 1.5383 -2.0746 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5486 0.8558 -2.2361 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7106 1.5893 -1.7469 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3052 1.3630 -0.5843 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3282 2.1763 -0.4223 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2302 2.1977 0.7738 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4894 1.4032 0.4806 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4016 1.4101 1.6566 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7864 0.8451 2.9182 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8652 0.8971 4.0069 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4037 2.9719 -1.5345 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4087 4.0346 -1.8003 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3813 2.6012 -2.3691 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0518 3.1818 -3.7106 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6343 -3.1768 1.0033 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5648 -4.1834 1.1295 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5294 -4.9512 2.6056 P 0 0 0 0 0 5 0 0 0 0 0 0 0.6567 -6.2054 2.6027 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9436 -3.9728 3.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1258 -5.3816 3.0339 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 -6.6798 2.6369 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7035 -7.1905 2.9832 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9982 -7.1821 4.3872 N 0 0 0 0 0 0 0 0 0 0 0 0 16.9270 1.2864 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