Mol:EEL0178
Copyright: ARM project http://www.metabolome.jp/
96 98 0 0 0 0 0 0 0 0999 V2000 -13.0336 -0.7161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4226 0.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8115 1.0349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1522 1.8207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2359 -0.1424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4253 0.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0124 1.5923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3781 2.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6638 1.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9494 2.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2348 1.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5204 2.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8060 1.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0916 2.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 1.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6626 2.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9483 1.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2339 2.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5195 1.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 2.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0904 1.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4018 -0.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7674 -0.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0530 -0.6993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3386 -0.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6241 -0.6993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9098 -0.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9151 -2.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2008 -1.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4863 -2.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7717 -1.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0574 -2.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6638 0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8060 0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9483 0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0904 0.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0530 -1.5416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9151 -2.8616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0574 -2.8616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3761 2.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3428 -1.6068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7384 -2.1258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0336 0.7178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4227 -0.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8118 -1.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1526 -1.8191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2360 0.1438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4256 -0.8277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0129 -1.5909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3786 -2.0327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6642 -1.6205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9499 -2.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2352 -1.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5209 -2.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8064 -1.6210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0921 -2.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3775 -1.6213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6631 -2.0338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9487 -1.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2344 -2.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5199 -1.6218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8055 -2.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0909 -1.6221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4018 0.7179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7675 0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0530 0.7004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3387 0.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6241 0.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9099 0.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9151 2.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2009 1.6068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4863 2.0191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7717 1.6065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0574 2.0188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6641 -0.7780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8062 -0.7786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9486 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0907 -0.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0528 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9149 2.8616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0572 2.8611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -2.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3429 1.6062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7382 1.4881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1089 -1.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1089 -0.7118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3951 -0.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6798 -0.7118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6798 -1.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6489 1.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6489 0.7318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3627 0.3181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 0.7318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 1.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9134 -2.1258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8513 -2.1258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 2 6 1 0 2 5 1 0 7 4 1 0 8 7 1 0 9 8 1 0 10 9 1 0 11 10 1 0 12 11 1 0 13 12 1 0 14 13 1 0 15 14 1 0 16 15 1 0 17 16 1 0 18 17 1 0 19 18 1 0 20 19 1 0 21 20 1 0 23 22 1 0 24 23 1 0 25 24 1 0 26 25 1 0 27 26 1 0 29 28 1 0 30 29 1 0 31 30 1 0 32 31 1 0 5 22 1 0 9 33 1 0 13 34 1 0 17 35 1 0 21 36 1 0 24 37 1 0 28 38 1 0 32 39 1 0 21 40 1 0 32 41 1 0 1 42 1 0 43 44 1 0 44 45 1 0 45 46 1 0 44 48 1 0 44 47 1 0 49 46 1 0 50 49 1 0 51 50 1 0 52 51 1 0 53 52 1 0 54 53 1 0 55 54 1 0 56 55 1 0 57 56 1 0 58 57 1 0 59 58 1 0 60 59 1 0 61 60 1 0 62 61 1 0 63 62 1 0 65 64 1 0 66 65 1 0 67 66 1 0 68 67 1 0 69 68 1 0 71 70 1 0 72 71 1 0 73 72 1 0 74 73 1 0 47 64 1 0 51 75 1 0 55 76 1 0 59 77 1 0 63 78 1 0 66 79 1 0 70 80 1 0 74 81 1 0 63 82 1 0 74 83 1 0 43 84 1 0 40 83 1 0 41 82 1 0 85 86 1 0 86 87 1 0 87 88 1 0 88 89 1 0 85 89 1 0 27 86 1 0 28 89 1 0 90 91 1 0 91 92 1 0 92 93 1 0 93 94 1 0 90 94 1 0 70 90 1 0 69 93 1 0 42 95 1 0 95 96 1 0
A 95 Glc A 96 Glc S SKP 6 AUTODRAW FALSE ID EEL0178 FORMULA C88H172O6 EXACTMASS 1325.315393236 AVERAGEMASS 1326.30368 SMILES C(C3C)CCC(C)C(C1)CCC1CCCC(C)CCOC(COCCC(C)CCCC(C)CCCC(CCCC(CCC(C)CCCC(C)C(C2)CCC(CCCC(CCOC([H])(COCCC(C)CCCC(CCCC(CCCC(C)CC3)C)C)COCC)C)2)C)C)([H])CO M END
