HMDB0285846 RDKit 3D PC(15:0/18:1(12Z)-2OH(9,10)) 133132 0 0 0 0 0 0 0 0999 V2000 2.6148 -3.2599 -6.6319 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3049 -2.6155 -6.2396 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4623 -1.9216 -4.8857 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5339 -0.8761 -5.0032 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7428 -0.1281 -3.7002 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 -0.9929 -2.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2561 -0.8667 -1.9413 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2463 0.1533 -2.2514 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5122 1.0954 -1.0827 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4745 2.0235 -1.4618 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0347 0.3330 0.1114 C 0 0 1 0 0 0 0 0 0 0 0 0 7.2134 -0.3551 -0.2616 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5161 1.3773 1.1237 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0447 0.7073 2.3483 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9653 -0.0937 3.0222 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8458 0.8151 3.4816 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7872 -0.0693 4.1488 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7119 0.8764 4.6692 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6007 0.0795 5.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 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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 1 10 70 1 0 11 71 1 1 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 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 35105 1 0 36106 1 0 36107 1 0 37108 1 0 37109 1 0 38110 1 0 38111 1 0 39112 1 0 39113 1 0 40114 1 0 40115 1 0 41116 1 0 41117 1 0 41118 1 0 42119 1 0 42120 1 0 48121 1 0 48122 1 0 49123 1 0 49124 1 0 51125 1 0 51126 1 0 51127 1 0 52128 1 0 52129 1 0 52130 1 0 53131 1 0 53132 1 0 53133 1 0 M CHG 2 46 -1 50 1 M END