Mol:EEL1029
Copyright: ARM project http://www.metabolome.jp/
111117 0 0 0 0 0 0 0 0999 V2000
10.7678 -2.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1337 -2.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4193 -2.0316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7049 -2.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9904 -2.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2761 -2.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3228 -0.7541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6084 -1.1666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8939 -0.7544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1795 -1.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4651 -0.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2891 2.8866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5748 2.4740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8604 2.8863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 2.4738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4316 2.8861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4192 -1.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3226 0.0884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 0.0878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2889 3.7288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4315 3.7282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0231 2.4235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0231 1.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7369 1.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 1.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 2.4235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1056 -1.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1056 -2.0307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8194 -2.4443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5344 -2.0307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5344 -1.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7353 0.6283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0217 1.9187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8754 3.1633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0929 3.9496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6485 1.1002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9531 3.7221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3192 4.1644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6046 3.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8904 4.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1756 3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4616 4.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5071 2.4784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 2.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0784 2.4796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3644 2.8925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6495 2.4808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9585 0.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3245 0.5651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6097 0.1533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8956 0.5663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1809 0.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4669 0.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4711 -1.1623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7571 -0.7493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0426 -1.1611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3282 -0.7481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6136 -1.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6038 2.9103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5064 1.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6488 1.6384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6090 -0.6890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4704 -2.0045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6129 -2.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2053 -0.6997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2058 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9199 0.5380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6348 0.1238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6343 -0.7006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2902 2.9300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2907 3.7544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0047 4.1677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7197 3.7535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7192 2.9291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6948 2.1545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0646 2.8939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1005 -0.7468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7172 2.4735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7508 -1.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1719 1.1787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1719 0.3543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8857 -0.0594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6009 0.3543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6009 1.1787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3155 -0.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0298 0.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8447 -2.2081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6382 -1.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7353 0.4344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1244 -0.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9378 -0.1395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1274 -1.1110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2034 -2.9479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1821 -3.1984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9145 -1.4778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2034 -3.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1821 -2.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9145 -2.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8983 -2.9479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0471 -1.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9179 -4.1677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8983 -3.7729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2034 -2.2599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0469 -0.9185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4677 -3.6109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2889 1.8463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4741 1.8518 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 11.4741 2.6767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4741 1.0268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6491 1.8518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8241 1.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 3 2 1 0 4 3 1 0 5 4 1 0 6 5 1 0 8 7 1 0 9 8 1 0 10 9 1 0 11 10 1 0 13 12 1 0 14 13 1 0 15 14 1 0 16 15 1 0 3 17 1 0 7 18 1 0 11 19 1 0 12 20 1 0 16 21 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 22 26 1 0 12 22 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 27 31 1 0 6 30 1 0 7 27 1 0 32 33 1 0 33 34 1 0 34 35 1 0 33 36 1 0 37 35 1 0 38 37 1 0 39 38 1 0 40 39 1 0 41 40 1 0 42 41 1 0 44 43 1 0 45 44 1 0 46 45 1 0 47 46 1 0 49 48 1 0 50 49 1 0 51 50 1 0 52 51 1 0 53 52 1 0 55 54 1 0 56 55 1 0 57 56 1 0 58 57 1 0 36 48 1 0 39 59 1 0 43 60 1 0 47 61 1 0 50 62 1 0 54 63 1 0 58 64 1 0 65 66 1 0 66 67 1 0 67 68 1 0 68 69 1 0 65 69 1 0 54 65 1 0 53 68 1 0 70 71 1 0 71 72 1 0 72 73 1 0 73 74 1 0 70 74 1 0 42 73 1 0 43 70 1 0 33 75 1 0 47 76 1 0 58 77 1 0 16 78 1 0 11 79 1 0 77 79 1 0 76 78 1 0 80 81 1 0 81 82 1 0 82 83 1 0 83 84 1 0 80 84 1 0 25 80 1 0 83 85 1 0 85 86 1 0 1 87 1 0 87 88 1 0 89 90 1 0 90 92 1 0 90 91 1 0 86 91 1 0 88 90 1 0 99 93 1 1 98 93 1 1 97 99 1 1 97 94 1 0 98 95 1 0 93 96 1 0
100 97 1 0
98100 1 0 96101 1 0 99102 1 0 93103 1 0
100104 1 0
94105 1 0 95 32 1 0
106107 1 0 107108 2 0 107109 1 0 107110 1 0 110111 1 0
89106 1 0
A 105 Glc A 111 Ino S SKP 6 AUTODRAW FALSE ID EEL1029 FORMULA C94H177O14P EXACTMASS 1561.287596882 AVERAGEMASS 1562.3765409999999 SMILES C(C65)CCC(C)CCOC(COCCC(CCCC(C2)CC(C(CCCC(C)CCC(CCCC(C)C(C3)CCC3C(C7)CC(C7)CCOC(COP(O)(=O)OC)(COCCC(C)CCCC(C4)CC(C(C)CCCC(CCC(C)CCCC(C)C(C6)CC5)C)C4)[H])C)C)C2)C)(COC(C1O)C(CO)(O)C(O)C1OC)[H] M END
