HMDB0286050 RDKit 3D PC(18:2(10E,12Z)+=O(9)/16:1(9Z)) 129128 0 0 0 0 0 0 0 0999 V2000 -0.1328 -2.9442 -3.9102 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2269 -2.5724 -5.3891 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3278 -1.5695 -5.5101 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -1.0776 -6.9126 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7358 -0.0717 -6.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 -0.7313 -6.2406 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5153 -0.3845 -5.1264 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0564 0.7236 -4.2806 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6619 1.0485 -3.1715 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3645 2.0766 -2.2422 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 2.0945 -1.2178 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3494 3.1201 -2.1594 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3618 3.2627 -3.2372 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4236 4.4613 -2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6939 4.2467 -1.7063 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2376 5.4101 -1.3885 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2845 5.6610 -2.3989 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2779 4.5822 -2.6509 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1046 4.2482 -1.4462 C 0 0 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13 71 1 0 13 72 1 0 14 73 1 0 14 74 1 0 15 75 1 0 15 76 1 0 16 77 1 0 16 78 1 0 17 79 1 0 17 80 1 0 18 81 1 0 18 82 1 0 22 83 1 0 22 84 1 0 23 85 1 1 24 86 1 0 24 87 1 0 30 88 1 0 30 89 1 0 31 90 1 0 31 91 1 0 33 92 1 0 33 93 1 0 33 94 1 0 34 95 1 0 34 96 1 0 34 97 1 0 35 98 1 0 35 99 1 0 35100 1 0 39101 1 0 39102 1 0 40103 1 0 40104 1 0 41105 1 0 41106 1 0 42107 1 0 42108 1 0 43109 1 0 43110 1 0 44111 1 0 44112 1 0 45113 1 0 45114 1 0 46115 1 0 47116 1 0 48117 1 0 48118 1 0 49119 1 0 49120 1 0 50121 1 0 50122 1 0 51123 1 0 51124 1 0 52125 1 0 52126 1 0 53127 1 0 53128 1 0 53129 1 0 M CHG 2 28 -1 32 1 M END