Mol:EEL3053
Copyright: ARM project http://www.metabolome.jp/
104103 0 0 0 0 0 0 0 0999 V2000
-12.2224 -2.7802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.8565 -1.5834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3827 -0.6601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8517 0.0967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4328 0.8824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5966 -1.0806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6258 -0.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3732 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6587 0.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9445 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2301 0.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5157 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8013 0.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0869 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3726 0.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6581 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9436 0.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2294 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5149 0.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8007 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0862 0.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3718 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6573 0.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7625 -0.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0480 -1.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3338 -0.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6195 -1.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9051 -0.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1907 -1.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4764 -0.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7619 -1.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0474 -0.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3330 -1.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6186 -0.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9045 -1.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -0.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4755 -1.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7611 -0.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9445 2.1373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0869 2.1373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2294 2.1373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3338 0.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4764 0.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6186 0.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7611 0.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7899 1.8118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3876 0.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8565 0.1714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4377 -0.6144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6015 1.3487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6307 0.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3781 -1.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6636 -0.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9494 -1.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2350 -0.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5206 -1.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8062 -0.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0918 -1.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3774 -0.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6630 -1.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9485 -0.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2343 -1.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5198 -0.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8055 -1.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0911 -0.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3767 -1.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1487 -1.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7674 0.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0529 1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3387 0.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6244 1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 0.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1956 1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4812 0.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7668 1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0523 0.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3379 1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6235 0.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9093 1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1949 0.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4804 1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7659 0.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9494 -1.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0918 -1.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2343 -1.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3767 -1.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3387 0.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4812 0.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6235 0.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7659 0.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0571 1.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5657 -0.6113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3718 2.1198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3275 -2.7716 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -11.3275 -1.9466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5025 -2.7716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3275 -3.5966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6775 -2.7716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1772 2.7716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3522 2.7716 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 10.5272 2.7716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3522 3.5966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3522 1.9466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7022 2.7716 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 46 99 1 0 99100 1 0
100101 1 0 100102 2 0 100103 1 0 101104 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
