HMDB0286296 RDKit 3D PC(18:3(10,12,15)-OH(9)/18:0) 137136 0 0 0 0 0 0 0 0999 V2000 1.7652 1.6781 -7.1576 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0039 2.5528 -6.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3521 2.6444 -5.5129 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5291 2.2256 -5.1035 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0101 2.2545 -3.7088 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0391 2.8129 -2.7438 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3146 3.8722 -2.0242 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3548 4.4411 -1.0523 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6532 5.5023 -0.3444 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7244 6.1186 0.6563 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4103 6.9020 1.5714 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0516 5.0068 1.4622 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1019 4.1737 2.1455 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4428 3.0748 2.9435 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5083 2.2097 3.5666 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0005 1.0926 4.3845 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 1.5716 5.5757 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7347 0.3862 6.3978 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8049 -0.5040 5.6361 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1683 -0.0779 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30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 32 35 1 0 23 36 1 0 36 37 1 0 37 38 2 0 37 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 1 56 1 0 1 57 1 0 1 58 1 0 2 59 1 0 2 60 1 0 3 61 1 0 4 62 1 0 5 63 1 0 5 64 1 0 6 65 1 0 7 66 1 0 8 67 1 0 9 68 1 0 10 69 1 0 11 70 1 0 12 71 1 0 12 72 1 0 13 73 1 0 13 74 1 0 14 75 1 0 14 76 1 0 15 77 1 0 15 78 1 0 16 79 1 0 16 80 1 0 17 81 1 0 17 82 1 0 18 83 1 0 18 84 1 0 22 85 1 0 22 86 1 0 23 87 1 1 24 88 1 0 24 89 1 0 30 90 1 0 30 91 1 0 31 92 1 0 31 93 1 0 33 94 1 0 33 95 1 0 33 96 1 0 34 97 1 0 34 98 1 0 34 99 1 0 35100 1 0 35101 1 0 35102 1 0 39103 1 0 39104 1 0 40105 1 0 40106 1 0 41107 1 0 41108 1 0 42109 1 0 42110 1 0 43111 1 0 43112 1 0 44113 1 0 44114 1 0 45115 1 0 45116 1 0 46117 1 0 46118 1 0 47119 1 0 47120 1 0 48121 1 0 48122 1 0 49123 1 0 49124 1 0 50125 1 0 50126 1 0 51127 1 0 51128 1 0 52129 1 0 52130 1 0 53131 1 0 53132 1 0 54133 1 0 54134 1 0 55135 1 0 55136 1 0 55137 1 0 M CHG 2 28 -1 32 1 M END