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0 0 0 0\n 14 11 1 0 0 0 0\n 15 12 1 0 0 0 0\n 16 13 1 0 0 0 0\n 17 15 1 0 0 0 0\n 18 16 1 0 0 0 0\n 19 14 1 0 0 0 0\n 20 23 1 0 0 0 0\n 21 25 1 0 0 0 0\n 22 24 1 0 0 0 0\n 23 28 1 0 0 0 0\n 24 62 1 0 0 0 0\n 25 45 1 0 0 0 0\n 26 64 1 0 0 0 0\n 27 26 1 0 0 0 0\n 28 27 1 0 0 0 0\n 29 18 1 0 0 0 0\n 30 29 1 0 0 0 0\n 31 30 1 0 0 0 0\n 32 31 1 0 0 0 0\n 33 17 1 0 0 0 0\n 34 33 1 0 0 0 0\n 35 34 1 0 0 0 0\n 36 35 1 0 0 0 0\n 37 36 1 0 0 0 0\n 38 37 1 0 0 0 0\n 39 38 1 0 0 0 0\n 40 39 1 0 0 0 0\n 41 40 1 0 0 0 0\n 42 41 1 0 0 0 0\n 43 42 1 0 0 0 0\n 44 43 1 0 0 0 0\n 45 44 1 0 0 0 0\n 46 32 1 0 0 0 0\n 47 46 1 0 0 0 0\n 48 47 1 0 0 0 0\n 49 48 1 0 0 0 0\n 50 19 1 0 0 0 0\n 51 50 1 0 0 0 0\n 52 51 1 0 0 0 0\n 53 52 1 0 0 0 0\n 54 53 1 0 0 0 0\n 55 54 1 0 0 0 0\n 56 55 1 0 0 0 0\n 57 56 1 0 0 0 0\n 58 57 1 0 0 0 0\n 59 58 1 0 0 0 0\n 60 59 1 0 0 0 0\n 61 60 1 0 0 0 0\n 62 61 1 0 0 0 0\n 63 49 1 0 0 0 0\n 64 63 1 0 0 0 0\n 65 21 1 0 0 0 0\n 66 20 1 0 0 0 0\n 67 22 1 0 0 0 0\nM END", "smiles": "CCCCCCCCCCCCCCCCCCOC(=O)CC(CC(=O)OCCCCCCCCCCCCCCCCCC)(C(=O)OCCCCCCCCCCCCCCCCCC)O", "formula": "C60H116O7", "atropisomerism": "No", "charge": 0, "count": 1, "stereochemistry": "ACHIRAL", "defined_stereo": 0, "ez_centers": 0, "molecular_weight": "949.5611", "optical_activity": "NONE", "references": [ "3f841353-05e4-4811-993c-5968fcead3de", "9dc862d8-d773-47af-b899-98bdcb70e3b7" ], "stereo_centers": 0 }, "unii": "M10B5XY389" } ] }