HMDB0275402 RDKit 3D PGP(i-17:0/20:3(6,8,11)-OH(5)) 139138 0 0 0 0 0 0 0 0999 V2000 0.0837 -6.3386 -2.9252 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4461 -6.6367 -1.4692 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5198 -5.6909 -1.0402 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -5.9426 0.3936 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4087 -7.3243 0.6156 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7651 -7.5267 2.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -6.6266 2.5941 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0741 -6.8843 4.0325 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0124 -6.5864 4.9785 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8331 -6.0397 4.7671 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8736 -5.8248 5.9143 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6113 -4.3643 5.9907 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5879 -3.8333 5.8599 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7377 -2.3873 5.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8744 -1.7364 5.8402 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9649 -0.2451 5.9425 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9872 0.1113 5.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4424 0.1946 7.2825 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5367 1.6728 7.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3258 2.5032 7.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5065 2.4806 6.1157 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7034 2.0623 6.1813 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9339 2.8849 4.8582 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0406 2.8043 3.7389 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3119 4.1279 3.1704 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6856 4.9015 2.6343 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8345 5.4059 3.1711 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1138 5.1648 4.3434 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6954 6.2402 2.2667 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4742 5.3269 1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5245 4.4863 0.5241 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5503 5.2718 -0.3297 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 4.2973 -0.9784 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 4.9274 -1.8755 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2822 3.7548 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3974 4.1934 -3.2814 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1656 2.9249 -3.6189 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3098 3.0963 -4.5191 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1812 3.6528 -5.8649 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3546 3.0137 -6.8968 C 0 0 0 0 0 0 0 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