Mol:EEL3041
Copyright: ARM project http://www.metabolome.jp/
101101 0 0 0 0 0 0 0 0999 V2000
-13.2836 1.1374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3743 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6601 1.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9459 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2313 1.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5169 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8026 1.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0882 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3736 1.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6592 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 1.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2305 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5162 1.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8017 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0872 1.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4118 -1.0752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7774 -0.6454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0632 -1.0578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3488 -0.6454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6343 -1.0578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9200 -0.6454 0.0000 C 0 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8.4369 -0.7827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7226 -1.1952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0079 -0.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2936 -1.1954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5792 -0.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8649 -1.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1503 -0.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4362 -1.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7218 -0.7838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0074 -1.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2929 -0.7840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5785 -1.1965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1361 -0.7843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1744 1.5556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5402 1.1258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8257 1.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1114 1.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3968 1.5378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6827 1.1253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9182 1.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2039 1.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 4.8368 2.3944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7522 -0.5270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1422 0.4696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4837 1.2561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.5655 -0.6510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.2522 -1.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7275 -2.4600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7105 1.4459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6800 0.1574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2523 0.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9092 -2.4617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6022 1.4421 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.6022 2.2671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4272 1.4421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6022 0.6171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6789 1.4471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2522 1.4421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7935 -2.4617 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 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 90 94 1 0 95 96 2 0 95 97 1 0 95 98 1 0 95 99 1 0 91 99 1 0 97100 1 0 94101 1 0
A 94 Gal A 100 Ino A 101 Glc S SKP 6 AUTODRAW FALSE ID EEL3041 FORMULA C89H179O9P EXACTMASS 1423.328673836 AVERAGEMASS 1424.341921 SMILES C(C1)CC(C)CCCC(CCCC(CCOC([H])(COCC)COCCC(CCCC(C)CCCC(C)CCCC(CCC(CCCC(CCCC(CCCC(CCOC([H])(COCCC(CCCC(CCCC(CCCC(CCC1C)C)C)C)C)COP(OC)(O)=O)C)C)C)C)C)C)C)C M END
