HMDB0289479 RDKit 3D PC(P-16:0/18:1(12Z)-2OH(9,10)) 135134 0 0 0 0 0 0 0 0999 V2000 3.8654 4.9473 -3.3524 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 4.5949 -1.9231 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0889 4.9662 -1.0197 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2927 4.6976 0.4236 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5029 3.2348 0.7921 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3171 2.4706 0.3936 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3306 1.4594 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 0.9056 -1.0757 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7424 -0.5417 -0.8047 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6385 -1.2984 -1.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9963 -0.9593 0.6018 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0256 -0.2380 1.1777 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7584 -1.0904 1.4259 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9908 -1.5382 2.8165 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8152 -0.7331 3.7175 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3212 0.6604 4.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9302 0.5961 4.6469 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3793 1.9355 5.0104 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0257 1.7457 5.6092 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9358 1.1817 4.5985 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6248 1.1652 3.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1787 0.6251 4.8503 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9987 0.1164 3.8170 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3595 0.7448 3.9533 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3371 2.0874 3.9161 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9968 3.0985 3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0324 3.1712 1.7979 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6108 4.4024 1.1166 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4885 4.2730 0.1354 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 3.3440 -1.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 3.3277 -1.9955 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8677 2.4216 -3.1552 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0357 0.9775 -2.8288 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 0.2056 -4.0874 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2935 0.3398 -5.1308 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0685 -0.1406 -4.6891 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0735 0.0326 -5.8259 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -0.4537 -5.3503 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4655 -0.3129 -6.4378 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7792 -0.8115 -5.9099 C 0 0 0 0 0 0 0 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41 1 0 23 42 1 0 42 43 1 0 43 44 1 0 44 45 2 0 44 46 1 0 44 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 50 53 1 0 1 54 1 0 1 55 1 0 1 56 1 0 2 57 1 0 2 58 1 0 3 59 1 0 3 60 1 0 4 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 8 68 1 0 9 69 1 6 10 70 1 0 11 71 1 6 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 19 85 1 0 19 86 1 0 23 87 1 6 24 88 1 0 24 89 1 0 26 90 1 0 27 91 1 0 28 92 1 0 28 93 1 0 29 94 1 0 29 95 1 0 30 96 1 0 30 97 1 0 31 98 1 0 31 99 1 0 32100 1 0 32101 1 0 33102 1 0 33103 1 0 34104 1 0 34105 1 0 35106 1 0 35107 1 0 36108 1 0 36109 1 0 37110 1 0 37111 1 0 38112 1 0 38113 1 0 39114 1 0 39115 1 0 40116 1 0 40117 1 0 41118 1 0 41119 1 0 41120 1 0 42121 1 0 42122 1 0 48123 1 0 48124 1 0 49125 1 0 49126 1 0 51127 1 0 51128 1 0 51129 1 0 52130 1 0 52131 1 0 52132 1 0 53133 1 0 53134 1 0 53135 1 0 M CHG 2 46 -1 50 1 M END