HMDB0287750 RDKit 3D PC(18:3(9,11,15)-OH(13)/20:5(5Z,8Z,11Z,14Z,17Z)) 133132 0 0 0 0 0 0 0 0999 V2000 4.9641 -2.5997 6.5917 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7969 -2.4304 5.5891 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4211 -3.7868 5.1917 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2476 -4.3147 5.3723 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1233 -3.5542 6.0305 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6785 -4.2477 7.2541 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5093 -4.7040 7.5166 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6246 -4.5669 6.5518 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -5.9273 6.1858 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0907 -6.4706 4.9989 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6226 -5.7339 3.8108 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7921 -5.6593 2.8602 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7844 -6.1710 1.6576 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6227 -6.8918 1.0785 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1479 -6.1959 -0.1463 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0701 -5.7265 -0.3125 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1652 -5.8039 0.6688 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7592 -4.4870 1.0711 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8418 -3.5018 1.6928 C 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1 0 47 48 1 0 48 49 2 0 48 50 1 0 48 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 54 56 1 0 54 57 1 0 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 0 4 64 1 0 5 65 1 0 5 66 1 0 6 67 1 0 7 68 1 0 8 69 1 0 8 70 1 0 9 71 1 0 10 72 1 0 11 73 1 0 11 74 1 0 12 75 1 0 13 76 1 0 14 77 1 0 14 78 1 0 15 79 1 0 16 80 1 0 17 81 1 0 17 82 1 0 18 83 1 0 18 84 1 0 19 85 1 0 19 86 1 0 23 87 1 1 24 88 1 0 24 89 1 0 28 90 1 0 28 91 1 0 29 92 1 0 29 93 1 0 30 94 1 0 30 95 1 0 31 96 1 0 31 97 1 0 32 98 1 0 32 99 1 0 33100 1 0 33101 1 0 34102 1 0 34103 1 0 35104 1 0 36105 1 0 37106 1 0 38107 1 0 39108 1 0 40109 1 0 41110 1 0 41111 1 0 42112 1 0 43113 1 0 44114 1 0 44115 1 0 45116 1 0 45117 1 0 45118 1 0 46119 1 0 46120 1 0 52121 1 0 52122 1 0 53123 1 0 53124 1 0 55125 1 0 55126 1 0 55127 1 0 56128 1 0 56129 1 0 56130 1 0 57131 1 0 57132 1 0 57133 1 0 M CHG 2 50 -1 54 1 M END