Mol:LBGPxpkk:R:16402BC01:16402BC01
60 56 0 0 0 0 0 0 0 0999 V2000 -1.1738 1.6516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6525 1.6890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3671 1.6754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3671 0.6484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2413 0.6484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3671 -0.6433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6185 -0.6433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7204 1.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7204 1.3274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 1.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 1.3274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6525 0.6484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5967 1.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5967 1.3274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 1.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3162 1.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0073 1.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4302 1.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1467 1.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8496 1.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2945 1.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0178 1.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2827 1.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8869 1.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6285 1.8978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 1.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2413 1.8978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 1.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7867 -0.6433 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.0772 -0.6433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7867 0.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1569 0.6484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7373 0.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7373 0.3259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 0.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 0.3259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5797 0.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5797 0.3259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3162 0.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0243 0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4472 0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1636 0.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8666 0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3114 0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0009 0.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2657 0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8699 0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -0.6433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7867 -1.5057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5012 -1.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 1.8146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8356 1.5770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6285 0.8962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 0.6059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2413 0.8962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9358 0.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 0.8131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8356 0.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 4 5 1 1 8 9 1 0 10 11 1 0 4 12 1 1 13 14 1 0 15 16 1 0 16 17 1 0 8 17 1 0 8 18 2 0 18 19 1 0 19 20 1 0 10 20 1 0 10 21 2 0 21 22 1 0 22 23 1 0 13 23 1 0 13 24 2 0 1 24 1 0 25 26 1 0 26 27 1 0 26 28 1 0 7 29 1 0 29 30 1 0 29 31 2 0 33 34 1 0 35 36 1 0 37 38 1 0 39 40 1 0 40 41 1 0 33 41 1 0 33 42 2 0 42 43 1 0 43 44 1 0 35 44 1 0 35 45 2 0 45 46 1 0 46 47 1 0 37 47 1 0 37 48 2 0 32 48 1 0 12 32 1 0 30 49 1 0 15 26 1 0 2 3 1 0 4 3 1 0 4 6 1 0 6 7 1 0 29 50 1 0 50 51 1 0 52 53 1 0 55 56 1 0 56 57 1 0 56 58 1 0 54 56 1 0 59 60 1 0
M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 50 51 M SBL 1 1 49 M SMT 1 OCH3 M SBV 1 49 0.0000 0.8624 S SKP 5 ID LBGPxpkk:R:16402BC01:16402BC01:01 FORMULA C52H101O6P EXACTMASS 852.733577474 AVERAGEMASS 853.328501 SMILES CC(CCC=C(C)CCC=C(C)CCCC(C)(C)C)=CCOCC(OCC=C(C)CCC=C(C)CCC=C(CCC)C)([H])COP(OC)(OC)=O M END
