Mol:EEL0156
Copyright: ARM project http://www.metabolome.jp/
106107 0 0 0 0 0 0 0 0999 V2000
-14.3083 0.8381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4069 2.0853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3366 2.9098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.1078 0.0394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1967 2.6814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5626 3.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8484 2.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1341 3.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4195 2.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7051 3.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9908 2.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2764 3.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5618 2.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8474 3.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1332 2.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4188 3.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7045 2.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9901 3.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2755 2.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3699 -0.8238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7357 -0.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0213 -0.8064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3070 -0.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5925 -0.8064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8782 -0.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 -0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3857 -0.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6713 -0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9568 -0.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2425 -0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8484 1.8684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9908 1.8684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1332 1.8684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2755 1.8684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0213 -1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 -1.7723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2425 -1.7723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5613 3.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -0.5175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8476 1.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2368 1.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6259 0.0561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9668 -0.7299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0502 1.2330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2398 0.2616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8271 -0.5016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1928 -0.9435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4785 -0.5312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7643 -0.9438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0496 -0.5315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3353 -0.9440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6208 -0.5317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9066 -0.9443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 -0.5320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4777 -0.9446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7634 -0.5323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -0.9448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3347 -0.5325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6203 -0.9451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0944 -0.5328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2160 1.8071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5818 1.3773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8674 1.7896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1531 1.3770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4385 1.7893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7243 1.3768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7298 3.1083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0155 2.6959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3011 3.1082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5865 2.6956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1279 3.1078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4784 0.3113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6206 0.3107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7633 0.3102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0946 0.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8672 2.6317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7296 3.9504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1281 3.9499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8086 -0.9454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8423 2.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0775 -1.6433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0775 -0.8189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8646 -0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4635 2.6453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4635 1.8210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1772 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8925 1.8210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8925 2.6453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3705 -0.3935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5949 -0.8309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5358 1.1275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1646 -1.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7080 -3.1238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.8897 -3.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7739 -3.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7118 -3.1255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8868 -3.1255 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.8868 -2.3006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8868 -3.9504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0618 -3.1255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6898 1.7962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5148 1.7962 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.5148 2.6211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3397 1.7962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5148 0.9712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1646 1.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 1 4 1 0 5 3 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 16 15 1 0 17 16 1 0 18 17 1 0 19 18 1 0 21 20 1 0 22 21 1 0 23 22 1 0 24 23 1 0 25 24 1 0 27 26 1 0 28 27 1 0 29 28 1 0 30 29 1 0 4 20 1 0 7 31 1 0 11 32 1 0 15 33 1 0 19 34 1 0 22 35 1 0 26 36 1 0 30 37 1 0 19 38 1 0 30 39 1 0 40 41 1 0 41 42 1 0 42 43 1 0 41 45 1 0 41 44 1 0 46 43 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 55 54 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 66 65 1 0 68 67 1 0 69 68 1 0 70 69 1 0 71 70 1 0 44 61 1 0 48 72 1 0 52 73 1 0 56 74 1 0 60 75 1 0 63 76 1 0 67 77 1 0 71 78 1 0 60 79 1 0 71 80 1 0 38 80 1 0 39 79 1 0 81 82 1 0 25 82 1 0 26 83 1 0 84 85 1 0 85 86 1 0 86 87 1 0 87 88 1 0 84 88 1 0 67 84 1 0 66 87 1 0 82 89 1 0 83 90 1 0 90 89 1 0 1 91 1 0 92 93 1 0 93 94 1 0 94 95 1 0 95 96 1 0 96 97 1 0 97 98 2 0 97 99 2 0 97100 1 0 92 1 1 0
101102 1 0 102103 2 0 102104 1 0 102105 1 0 104106 1 0
40101 1 0
A 94 Gal A 95 Glc A 106 Ino S SKP 6 AUTODRAW FALSE ID EEL0156 FORMULA C89H177O13PS EXACTMASS 1517.26475295 AVERAGEMASS 1518.3896409999998 SMILES C(C2)(C1)C(C)CCCC(CCC(CCCC(C)CCCC(C)CCCC(CCOCC(COCCOS(O)(=O)=O)([H])OCCC(CCCC(CCCC(CCCC(CCC(C)CCCC(C)CCCC(CCCC(CCOCC([H])(OCCC(CCCC1C2)C)COP(O)(=O)OC)C)C)C)C)C)C)C)C)C M END
