Mol:EEL0235
Copyright: ARM project http://www.metabolome.jp/
96 98 0 0 0 0 0 0 0 0999 V2000 -11.6720 -0.4445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2232 1.5088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5891 1.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8748 1.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1604 1.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4458 1.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7314 1.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0170 1.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3026 1.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5880 1.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8736 1.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1594 1.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4451 1.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7307 1.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0162 1.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3016 1.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6128 -0.8002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9784 -0.3704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2640 -0.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5496 -0.3704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8351 -0.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1208 -0.3704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1262 -2.1028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -1.6904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6975 -2.1028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9829 -1.6904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2686 -2.1028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8748 0.6957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0170 0.6957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1594 0.6957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3016 0.6957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2640 -1.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1262 -2.9451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2686 -2.9451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5873 1.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -1.6903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2110 -0.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6001 -1.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9409 -1.9026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0243 0.0603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8011 -1.6744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1670 -2.1162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4527 -1.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7384 -2.1165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0237 -1.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3094 -2.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5949 -1.7045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8806 -2.1170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 -1.7048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4516 -2.1173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7372 -1.7051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 -2.1175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3086 -1.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5942 -2.1178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8796 -1.7056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1902 0.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5560 0.2046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8415 0.6169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1272 0.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4126 0.6166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6984 0.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7036 1.9358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9895 1.5233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 1.9356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5604 1.5230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8461 1.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4526 -0.8615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5947 -0.8621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7371 -0.8626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8794 -0.8631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8413 1.4592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7034 2.7780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8459 2.7775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1653 -2.1181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1316 1.5227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3199 -1.6198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3199 -0.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6061 -0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8908 -0.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8908 -1.6198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4374 1.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4374 0.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1512 0.2346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8665 0.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8665 1.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9700 1.8594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7239 1.2880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7321 0.3352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0126 2.0718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5062 2.9451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6812 2.9451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9485 1.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7860 -0.9829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0126 -1.8312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5176 -2.8756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6926 -2.8756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3 2 1 0 4 3 1 0 5 4 1 0 6 5 1 0 7 6 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 18 17 1 0 19 18 1 0 20 19 1 0 21 20 1 0 22 21 1 0 24 23 1 0 25 24 1 0 26 25 1 0 27 26 1 0 1 17 1 0 4 28 1 0 8 29 1 0 12 30 1 0 16 31 1 0 19 32 1 0 23 33 1 0 27 34 1 0 16 35 1 0 27 36 1 0 37 38 1 0 38 39 1 0 37 40 1 0 41 39 1 0 42 41 1 0 43 42 1 0 44 43 1 0 45 44 1 0 46 45 1 0 47 46 1 0 48 47 1 0 49 48 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 57 56 1 0 58 57 1 0 59 58 1 0 60 59 1 0 61 60 1 0 63 62 1 0 64 63 1 0 65 64 1 0 66 65 1 0 40 56 1 0 43 67 1 0 47 68 1 0 51 69 1 0 55 70 1 0 58 71 1 0 62 72 1 0 66 73 1 0 55 74 1 0 66 75 1 0 35 75 1 0 36 74 1 0 76 77 1 0 77 78 1 0 78 79 1 0 79 80 1 0 76 80 1 0 22 77 1 0 23 80 1 0 81 82 1 0 82 83 1 0 83 84 1 0 84 85 1 0 81 85 1 0 62 81 1 0 61 84 1 0 2 86 1 0 86 87 1 0 1 88 1 0 87 89 1 0 88 87 1 0 89 90 1 0 90 91 1 0 87 92 1 0 38 93 1 0 38 94 1 0 94 95 1 0 95 96 1 0
A 91 Gul A 96 Glc S SKP 6 AUTODRAW FALSE ID EEL0235 FORMULA C88H172O6 EXACTMASS 1325.315393236 AVERAGEMASS 1326.30368 SMILES C(C3C)CC(C)CCCC(C(C1)CCC1CCCC(CCOCC(OCCC(C)CCCC(C)CCCC(C)CCCC(CCC(C)CCCC(C(C2)CCC2CCCC(CCOCC(OCCC(C)CCCC(C)CCCC(C)CCC3)([H])COC)C)C)C)([H])COC)C)C M END
