Mol:EEL3053
Copyright: ARM project http://www.metabolome.jp/
104103 0 0 0 0 0 0 0 0999 V2000
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0 0 -11.0585 0.7037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2011 0.7037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3433 0.7037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4858 0.7037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0652 2.2865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6629 1.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1318 0.6461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7130 -0.1397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8768 1.8234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9060 0.9320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6534 -0.5522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9389 -0.1397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2247 -0.5522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5103 -0.1397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7959 -0.5522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0815 -0.1397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3671 -0.5522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6527 -0.1397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9383 -0.5522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2238 -0.1397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5096 -0.5522 0.0000 C 0 0 0 0 0 0 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0 0 0 0 5.3671 -1.3945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5096 -1.3945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -1.3945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6140 0.5140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7565 0.5140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8988 0.5140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9588 0.5140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6676 1.7696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -0.1366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0965 2.5945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0522 -2.2969 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -13.0522 -1.4719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2272 -2.2969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.0522 -3.1219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4022 -2.2969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1062 2.2969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9312 2.2969 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.7562 2.2969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9312 1.4719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9312 3.1219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5812 2.2969 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 4 5 1 0 3 7 1 0 3 6 1 0 8 5 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 22 21 1 0 23 22 1 0 25 24 1 0 26 25 1 0 27 26 1 0 28 27 1 0 29 28 1 0 30 29 1 0 31 30 1 0 32 31 1 0 33 32 1 0 34 33 1 0 35 34 1 0 36 35 1 0 37 36 1 0 38 37 1 0 6 24 1 0 10 39 1 0 14 40 1 0 18 41 1 0 26 42 1 0 30 43 1 0 34 44 1 0 38 45 1 0 46 47 1 0 47 48 1 0 48 49 1 0 47 51 1 0 47 50 1 0 52 49 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 64 63 1 0 65 64 1 0 66 65 1 0 69 68 1 0 70 69 1 0 71 70 1 0 72 71 1 0 73 72 1 0 74 73 1 0 75 74 1 0 76 75 1 0 77 76 1 0 78 77 1 0 79 78 1 0 80 79 1 0 81 80 1 0 82 81 1 0 50 68 1 0 54 83 1 0 58 84 1 0 62 85 1 0 66 86 1 0 70 87 1 0 74 88 1 0 78 89 1 0 82 90 1 0 38 67 1 0 23 91 1 0 82 91 1 0 66 92 1 0 22 93 1 0 94 95 2 0 94 96 1 0 94 97 1 0 96 98 1 0 1 94 1 0 99100 1 0
100101 1 0 100102 2 0 100103 1 0 101104 1 0
46 99 1 0
A 98 Ino A 104 Ino S SKP 6 AUTODRAW FALSE ID EEL3053 FORMULA C88H180O12P2 EXACTMASS 1491.2950042440002 AVERAGEMASS 1492.311122 SMILES C(C(CCCC(CCCC(CCCC(C)CCC(CCCC(CCCC(C)CCCC(CCOCC(OCCC(C)CCCC(CCCC(CCCC(C)C)C)C)([H])COP(O)(=O)OC)C)C)C)C)C)C)COC(COP(OC)(O)=O)([H])COCCC(CCCC(C)CCCC(CCCC(C)C)C)C M END
