HMDB0285984 RDKit 3D PC(18:3(10,12,15)-OH(9)/16:0) 131130 0 0 0 0 0 0 0 0999 V2000 8.9345 3.3579 -5.1087 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0768 4.4043 -5.7856 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3273 5.2140 -4.7894 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4235 5.0104 -3.4829 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6426 5.8561 -2.5044 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7394 4.9802 -1.7106 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7790 4.8582 -0.3987 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8449 3.9693 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7946 3.7732 1.5693 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7766 2.8240 2.1057 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9093 2.6720 3.4833 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 3.2931 1.7645 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3944 2.2958 2.3184 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 2.6552 2.0425 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8903 1.5694 2.6279 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3573 1.7389 2.4663 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9419 2.9644 3.0988 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4146 2.9866 2.8964 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8528 3.0578 1.4768 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0372 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4 60 1 0 5 61 1 0 5 62 1 0 6 63 1 0 7 64 1 0 8 65 1 0 9 66 1 0 10 67 1 0 11 68 1 0 12 69 1 0 12 70 1 0 13 71 1 0 13 72 1 0 14 73 1 0 14 74 1 0 15 75 1 0 15 76 1 0 16 77 1 0 16 78 1 0 17 79 1 0 17 80 1 0 18 81 1 0 18 82 1 0 22 83 1 0 22 84 1 0 23 85 1 6 24 86 1 0 24 87 1 0 30 88 1 0 30 89 1 0 31 90 1 0 31 91 1 0 33 92 1 0 33 93 1 0 33 94 1 0 34 95 1 0 34 96 1 0 34 97 1 0 35 98 1 0 35 99 1 0 35100 1 0 39101 1 0 39102 1 0 40103 1 0 40104 1 0 41105 1 0 41106 1 0 42107 1 0 42108 1 0 43109 1 0 43110 1 0 44111 1 0 44112 1 0 45113 1 0 45114 1 0 46115 1 0 46116 1 0 47117 1 0 47118 1 0 48119 1 0 48120 1 0 49121 1 0 49122 1 0 50123 1 0 50124 1 0 51125 1 0 51126 1 0 52127 1 0 52128 1 0 53129 1 0 53130 1 0 53131 1 0 M CHG 2 28 -1 32 1 M END