Mol:LBGTGccc:18206SC05:18303HP01:18206SC05
67 66 0 0 0 0 0 0 0 0999 V2000 -6.8483 2.2134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0233 2.2134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8483 1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8483 0.5634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8483 -0.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8483 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0233 0.5488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0233 -0.9777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3454 0.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6313 0.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9172 0.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2029 0.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4888 0.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7745 0.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0604 0.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3463 0.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 0.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0821 0.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3454 -0.6142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7964 0.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5105 0.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2246 0.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9389 0.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 0.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3673 0.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2927 1.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5786 2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8643 1.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1502 2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4361 1.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7218 2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0077 1.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2935 2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4207 1.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1348 2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 1.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2774 1.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9915 2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7057 1.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4199 2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 1.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8483 2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2927 0.8323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3090 -1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5949 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8808 -1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1665 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4524 -1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7382 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3099 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4043 -1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1185 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8327 -1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5468 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 -1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9752 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6893 -1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4036 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3090 -2.2134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0814 0.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7955 0.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1177 -1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8318 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5632 2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -0.3962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3449 -0.8078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 8 1 0 4 7 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 9 19 2 0 18 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 24 25 2 0 2 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 2 0 35 36 1 0 37 38 1 0 38 39 1 0 39 40 2 0 40 41 1 0 41 42 1 0 26 43 2 0 8 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 2 0 53 54 1 0 54 55 1 0 55 56 2 0 56 57 1 0 57 58 1 0 58 59 2 0 44 60 2 0 25 61 1 0 61 62 1 0 59 63 1 0 63 64 1 0 36 65 1 0 37 65 2 0 17 66 1 0 66 67 1 0
M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 66 67 M SBL 1 1 65 M SMT 1 OOH M SBV 1 65 0.0000 0.6069 S SKP 5 ID LBGTGccc:18206SC05:18303HP01:18206SC05:01 FORMULA C59H96O8 EXACTMASS 932.7105200479999 AVERAGEMASS 933.38874 SMILES C(C)C=CCC=CC=CC(OO)CCCCCCCC(OC(CCOC(=O)CCCCCCCC=CCC=CCC=CCC)CCOC(=O)CCCCCCCC=CCC=CCC=CCC)=O M END
