Mol:EEL3029
Copyright: ARM project http://www.metabolome.jp/
101101 0 0 0 0 0 0 0 0999 V2000
11.3673 1.5443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1922 1.5443 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 12.1922 2.3693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0172 1.5443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1922 0.7193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.6413 -2.3693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.1104 -1.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6916 -0.8267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1607 -0.0698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7417 0.7158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.9056 -1.2472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.9348 -0.3557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6821 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9678 0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2535 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5391 0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8247 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1103 0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3959 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6816 0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9672 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2527 0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5385 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8241 0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1099 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3953 0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9665 0.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0715 -0.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3570 -1.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6428 -0.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9285 -1.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2141 -0.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4998 -1.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7855 -0.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0709 -1.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3565 -0.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6422 -1.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9277 -0.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2137 -1.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4992 -0.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7847 -1.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0703 -0.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2535 1.9707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3959 1.9707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5385 1.9707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6428 0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7855 0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9277 0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0703 0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4966 1.5474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0779 0.7616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5468 0.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1281 -0.7810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2920 1.1821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3211 0.2907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0686 -1.1935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3541 -0.7810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6398 -1.1935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9254 -0.7810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2112 -1.1935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4967 -0.7810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7823 -1.1935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 -0.7810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3535 -1.1935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6392 -0.7810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9249 -1.1935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2105 -0.7810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4961 -1.1935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2183 -0.7810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9326 -1.1935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4579 -1.1904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4578 0.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7433 1.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0291 0.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3149 1.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6006 0.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8861 1.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1717 0.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4574 1.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 0.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0285 1.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3141 0.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 1.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1145 0.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8289 1.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5434 0.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6398 -2.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7823 -2.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9249 -2.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9326 -2.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0291 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1717 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3141 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5434 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2522 1.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7436 -0.7779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 1.9532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7317 1.1318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4462 1.5443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1607 1.1318 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 2 5 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 8 12 1 0 8 11 1 0 13 10 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 24 23 1 0 25 24 1 0 26 25 1 0 27 26 1 0 28 27 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 39 38 1 0 40 39 1 0 41 40 1 0 42 41 1 0 43 42 1 0 11 29 1 0 15 44 1 0 19 45 1 0 23 46 1 0 31 47 1 0 35 48 1 0 39 49 1 0 43 50 1 0 51 52 1 0 52 53 1 0 53 54 1 0 52 56 1 0 52 55 1 0 57 54 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 67 66 1 0 68 67 1 0 69 68 1 0 70 69 1 0 71 70 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 83 82 1 0 84 83 1 0 85 84 1 0 86 85 1 0 87 86 1 0 55 73 1 0 59 88 1 0 63 89 1 0 67 90 1 0 71 91 1 0 75 92 1 0 79 93 1 0 83 94 1 0 87 95 1 0 43 72 1 0 28 96 1 0 72 97 1 0 87 96 1 0 71 97 1 0 51 1 1 0 27 98 1 0 4 99 1 0 99100 1 0
100101 1 0 S SKP 6 AUTODRAW FALSE ID EEL3029 FORMULA C88H178NO9P EXACTMASS 1424.323922809 AVERAGEMASS 1425.3300210000002 SMILES C(C1)C(C)CCCC(C)CCCC(C)CCCC(CCOCC(COP(O)(=O)OCCN)(OCCC(CCCC(C)CCCC(CCCC(C)CCC(C)CCCC(C)CCCC(CCCC(C)CCOCC(OCCC(C)CCCC(C)CCCC(CCCC1C)C)([H])CO)C)C)C)[H])C M END
