Mol:EEL0002
Copyright: ARM project http://www.metabolome.jp/
98 98 0 0 0 0 0 0 0 0999 V2000 -12.7966 0.9185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8873 1.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1732 1.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4588 1.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7442 1.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0298 1.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3155 1.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6011 1.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8865 1.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1722 1.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4579 1.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7434 1.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0291 1.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3146 1.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 1.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9248 -1.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2905 -0.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5761 -1.2768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8617 -0.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1472 -1.2768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4329 -0.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6547 -1.4005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9403 -0.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2259 -1.4005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5113 -0.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -1.4005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1732 0.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3155 0.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4579 0.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 0.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5761 -2.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6547 -2.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -2.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8857 1.4153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0825 -0.9880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6826 0.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0717 -0.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4126 -1.2003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4960 0.7626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2728 -0.9721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6385 -1.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9241 -1.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2099 -1.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4952 -1.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7809 -1.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0665 -1.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3522 -1.4147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6376 -1.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9233 -1.4150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -1.0028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4946 -1.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7801 -1.0030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0657 -1.4155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3511 -1.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6617 1.3367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0274 0.9069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3130 1.3192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5987 0.9066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8841 1.3189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1700 0.9064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4054 1.4005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6911 0.9880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9765 1.4003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2619 0.9877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4524 1.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9240 -0.1592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0663 -0.1598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2089 -0.1603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3509 -0.1608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3128 2.1614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4052 2.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4526 2.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3632 -1.4158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1669 0.9874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6322 -2.1138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6322 -1.2893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4194 -0.9175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1392 0.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6228 0.9369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3381 1.3506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9252 -0.8640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1497 -1.3013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 1.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3241 2.1755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2652 -0.7460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6552 0.2507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9967 1.0372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.0785 -0.8700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.7652 -1.4023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4468 -2.1634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1979 1.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1673 -0.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7653 -0.0898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1153 1.2249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9402 1.2249 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.9402 2.0499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7652 1.2249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9402 0.3999 0.0000 O 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 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 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 3 27 1 0 7 28 1 0 11 29 1 0 15 30 1 0 18 31 1 0 22 32 1 0 26 33 1 0 15 34 1 0 26 35 1 0 36 37 1 0 37 38 1 0 36 39 1 0 40 38 1 0 41 40 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 56 55 1 0 57 56 1 0 58 57 1 0 59 58 1 0 60 59 1 0 62 61 1 0 63 62 1 0 64 63 1 0 65 64 1 0 39 55 1 0 42 66 1 0 46 67 1 0 50 68 1 0 54 69 1 0 57 70 1 0 61 71 1 0 65 72 1 0 54 73 1 0 65 74 1 0 34 74 1 0 35 73 1 0 75 76 1 0 21 76 1 0 22 77 1 0 79 80 1 0 61 78 1 0 60 80 1 0 76 81 1 0 77 82 1 0 82 81 1 0 79 83 1 0 83 78 1 0 80 84 1 0 85 86 1 0 86 87 1 0 85 88 1 0 16 88 1 0 1 87 1 0 85 89 1 0 89 90 1 0 36 91 1 0 36 92 1 0 85 93 1 0 94 95 1 0 95 96 2 0 95 97 1 0 95 98 1 0 91 94 1 0
S SKP 6 AUTODRAW FALSE ID EEL0002 FORMULA C86H173O9P EXACTMASS 1381.281723644 AVERAGEMASS 1382.262181 SMILES C(C(C)1)CCC(C)CCCC(C)CCC(C)CCCC(C)CCCC(C)CCCC(CCOC(COCCC(CCCC(CCCC(C)CCCC(C)CCC(CCCC(C)CCCC(C)CCCC(CCOC(COCCC(CCC1)C)([H])CO)C)C)C)C)(COP(O)(O)=O)[H])C M END
