HMDB0113568 RDKit 3D PE-NMe(22:2(13Z,16Z)/18:0) 144143 0 0 0 0 0 0 0 0999 V2000 13.9170 5.1623 -1.2245 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8639 5.3637 -0.1691 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1648 4.7046 1.1181 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4067 3.2649 1.1888 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3903 2.2730 0.7992 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9858 2.3192 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1940 1.3043 -1.4328 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8511 0.0897 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1855 -1.2027 -1.0285 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9819 -1.5813 -1.3259 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9002 -0.7121 -1.7433 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6755 -0.8677 -0.7733 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2040 -2.2617 -0.7809 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0069 -2.5445 0.0294 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9676 -2.3183 1.4752 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0521 -0.9708 2.0522 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9038 -0.0598 1.5951 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5888 -0.6429 2.0068 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4541 0.2377 1.6041 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3923 0.4421 0.1288 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1526 1.3161 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0149 0.4903 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1559 0.9724 1.1921 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0117 -0.8320 0.0228 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0766 -1.7693 0.4132 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3243 -1.3788 -0.0147 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3278 -1.4288 -1.5524 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8262 -2.6803 -1.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7889 -2.8294 -3.5764 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.6500 -1.7931 -4.2396 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8207 -2.6842 -4.0929 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3374 -4.4063 -3.9441 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9952 -5.2151 -2.8662 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4546 -6.6492 -3.1154 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0709 -7.4577 -1.9536 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8612 -7.0366 -0.8132 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1605 -2.4275 0.4151 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2586 -2.2723 1.2424 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5488 -1.1226 1.6362 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0615 -3.4887 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