Mol:EEL0152
Copyright: ARM project http://www.metabolome.jp/
101107 0 0 0 0 0 0 0 0999 V2000
10.4239 -2.8636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7896 -3.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0752 -2.8932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3608 -3.3057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6464 -2.8935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9321 -3.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9788 -1.6158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2644 -2.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5499 -1.6161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8356 -2.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -1.6163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9451 2.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2308 1.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5164 2.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8019 1.6123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0875 2.0246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0751 -2.0510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9786 -0.7733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1209 -0.7739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9449 2.8671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0874 2.8665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 1.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 0.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3928 0.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1080 0.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1080 1.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7615 -2.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7615 -2.8922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4753 -3.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1905 -2.8922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1905 -2.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2971 2.8604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6632 3.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9486 2.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2344 3.3039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5197 2.8921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8057 3.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8512 1.6169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1371 2.0298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4224 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7084 2.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9935 1.6193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8152 -2.0240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1012 -1.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3865 -2.0228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6722 -1.6098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9576 -2.0216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9478 2.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8505 0.7744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9928 0.7768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8145 -2.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9569 -2.8636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5493 -1.5614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5498 -0.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2639 -0.3237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9788 -0.7379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9783 -1.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6342 2.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6347 2.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3487 3.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0637 2.8918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0632 2.0675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2794 2.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2435 -1.6085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3731 1.6120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4067 -2.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8279 0.3171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8279 -0.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5417 -0.9211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2568 -0.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2568 0.3171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9714 -0.9196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6857 -0.5068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5007 -3.0697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2942 -2.1757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3912 -0.4273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7804 -1.1811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5938 -1.0012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7834 -1.9727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0959 0.3429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1162 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1162 0.5034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4024 0.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6872 0.5034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6872 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8309 0.9153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5451 0.5022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7676 1.2155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1576 2.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4991 2.9985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5809 1.0915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3912 -0.1627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7429 -2.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2677 1.8718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9246 -2.1217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9154 -2.1217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7538 -2.1052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9288 -2.1052 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.9288 -1.2803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9288 -2.9302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1038 -2.1052 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 8 7 1 0 9 8 1 0 10 9 1 0 11 10 1 0 13 12 1 0 14 13 1 0 15 14 1 0 16 15 1 0 3 17 1 0 7 18 1 0 11 19 1 0 12 20 1 0 16 21 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 22 26 1 0 12 22 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 27 31 1 0 6 30 1 0 7 27 1 0 33 32 1 0 34 33 1 0 35 34 1 0 36 35 1 0 37 36 1 0 39 38 1 0 40 39 1 0 41 40 1 0 42 41 1 0 44 43 1 0 45 44 1 0 46 45 1 0 47 46 1 0 34 48 1 0 38 49 1 0 42 50 1 0 43 51 1 0 47 52 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 53 57 1 0 43 53 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 58 62 1 0 37 61 1 0 38 58 1 0 42 63 1 0 47 64 1 0 16 65 1 0 11 66 1 0 64 66 1 0 63 65 1 0 67 68 1 0 68 69 1 0 69 70 1 0 70 71 1 0 67 71 1 0 25 67 1 0 70 72 1 0 72 73 1 0 1 74 1 0 74 75 1 0 76 77 1 0 77 79 1 0 77 78 1 0 76 80 1 0 73 78 1 0 75 77 1 0 81 82 1 0 82 83 1 0 83 84 1 0 84 85 1 0 81 85 1 0 56 85 1 0 82 86 1 0 86 87 1 0 88 89 1 0 89 90 1 0 88 91 1 0 88 92 1 0 92 93 1 0 88 94 1 0 93 95 1 0 32 90 1 0 91 87 1 0 95 96 1 0 97 98 1 0 98 99 2 0 98100 2 0 98101 1 0 96 97 1 0
A 95 Gal A 96 Glc S SKP 6 AUTODRAW FALSE ID EEL0152 FORMULA C88H164O10S EXACTMASS 1413.204522158 AVERAGEMASS 1414.30376 SMILES C(C(C)6)COCC(CO)([H])OCCC(C1)CCC(C(C2)CCC2C(CCCC(C)CCC(CCCC(C)C(C3)CCC3CCCC(CCOCC([H])(COCCOS(O)(=O)=O)OCCC(C4)CCC(C(C7)CC(C7)C(CCCC(CCC(C)CCCC(C(C5)CCC(CCC6)5)C)C)C)4)C)C)C)1 M END
