HMDB0286573 RDKit 3D PC(18:1(12Z)-2OH(9,10)/18:2(9Z,12Z)) 138137 0 0 0 0 0 0 0 0999 V2000 1.9289 3.6024 -6.0069 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6985 4.5435 -6.8561 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8638 3.9875 -7.5694 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7135 2.8827 -8.5014 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4383 1.4867 -8.0867 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5534 0.8958 -7.2914 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5554 0.3490 -6.1401 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3649 0.1799 -5.3108 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4901 0.7931 -3.9655 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2082 0.0727 -2.9061 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7616 -1.3051 -2.9886 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3566 -1.4348 -2.3776 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3778 -1.1876 -0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0658 -1.1510 -0.4473 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2868 -1.1459 1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5045 -0.1062 1.7446 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0957 -0.1415 3.2408 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3044 -1.4505 3.8376 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8324 -2.3899 3.2196 O 0 0 0 0 0 0 0 0 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1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 38 39 2 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 21 45 1 0 45 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 47 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 53 55 1 0 53 56 1 0 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 0 2 61 1 0 3 62 1 0 3 63 1 0 4 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 6 68 1 0 7 69 1 0 8 70 1 0 8 71 1 0 9 72 1 0 10 73 1 0 11 74 1 0 11 75 1 0 12 76 1 0 12 77 1 0 13 78 1 0 13 79 1 0 14 80 1 0 14 81 1 0 15 82 1 0 15 83 1 0 16 84 1 0 16 85 1 0 17 86 1 0 17 87 1 0 21 88 1 6 22 89 1 0 22 90 1 0 26 91 1 0 26 92 1 0 27 93 1 0 27 94 1 0 28 95 1 0 28 96 1 0 29 97 1 0 29 98 1 0 30 99 1 0 30100 1 0 31101 1 0 31102 1 0 32103 1 0 32104 1 0 33105 1 6 34106 1 0 35107 1 1 36108 1 0 37109 1 0 37110 1 0 38111 1 0 39112 1 0 40113 1 0 40114 1 0 41115 1 0 41116 1 0 42117 1 0 42118 1 0 43119 1 0 43120 1 0 44121 1 0 44122 1 0 44123 1 0 45124 1 0 45125 1 0 51126 1 0 51127 1 0 52128 1 0 52129 1 0 54130 1 0 54131 1 0 54132 1 0 55133 1 0 55134 1 0 55135 1 0 56136 1 0 56137 1 0 56138 1 0 M CHG 2 49 -1 53 1 M END