Mol:EEL3035
Copyright: ARM project http://www.metabolome.jp/
105105 0 0 0 0 0 0 0 0999 V2000
-16.6096 -1.9935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1018 1.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9267 1.1713 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 12.9267 1.9963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7518 1.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9267 0.3463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.5730 -1.9892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3759 -1.9855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9571 -1.1997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4262 -0.4428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0072 0.3428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.1711 -1.6202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2003 -0.7287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9476 0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2332 0.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5190 0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8046 0.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0902 0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3757 0.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6613 0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9471 0.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2327 0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5182 0.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8039 0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0895 0.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3754 0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6608 0.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9465 0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2319 0.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3369 -1.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6225 -1.5653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9083 -1.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1940 -1.5653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4795 -1.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7652 -1.5653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0510 -1.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3364 -1.5653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6220 -1.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9076 -1.5653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1931 -1.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4792 -1.5653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7647 -1.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0502 -1.5653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3357 -1.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5190 1.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6613 1.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8039 1.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9083 -0.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0510 -0.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1931 -0.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3357 -0.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2312 1.1744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8125 0.3886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2814 -0.3682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8627 -1.1540 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0265 0.8091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0556 -0.0822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8031 -1.5665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0886 -1.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3743 -1.5665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6600 -1.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9457 -1.5665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2312 -1.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5168 -1.5665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8026 -1.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0881 -1.5665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3737 -1.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6594 -1.5665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 -1.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2307 -1.5665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5163 -1.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -1.5665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7234 -1.5634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1923 0.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4778 0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7637 0.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0495 0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3351 0.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6206 0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9062 0.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4775 0.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0486 0.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3346 0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6201 0.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0944 0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8089 0.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3743 -2.4088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5168 -2.4088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6594 -2.4088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -2.4088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7637 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9062 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0486 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8089 -0.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5177 0.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0091 -1.1509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9465 1.5802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4662 1.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1806 1.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8951 1.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8951 2.4088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6096 1.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1806 0.3463 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 3 4 2 0 3 5 1 0 3 6 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 9 13 1 0 9 12 1 0 14 11 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 29 28 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 44 43 1 0 12 30 1 0 16 45 1 0 20 46 1 0 24 47 1 0 32 48 1 0 36 49 1 0 40 50 1 0 44 51 1 0 52 53 1 0 53 54 1 0 54 55 1 0 53 57 1 0 53 56 1 0 58 55 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 72 71 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 88 87 1 0 56 74 1 0 60 89 1 0 64 90 1 0 68 91 1 0 72 92 1 0 76 93 1 0 80 94 1 0 84 95 1 0 88 96 1 0 44 73 1 0 29 97 1 0 73 98 1 0 88 97 1 0 72 98 1 0 52 2 1 0 28 99 1 0 5100 1 0
100101 1 0 101102 1 0 102103 2 0 102104 1 0 101105 1 0
1 7 1 0
A 1 Glc A 7 Glc S SKP 6 AUTODRAW FALSE ID EEL3035 FORMULA C91H182NO10P EXACTMASS 1480.3501375590001 AVERAGEMASS 1481.393281 SMILES C(O1)(COCCC(C)CCCC(C)CCCC(C)CCCC(C)CCC(C)CCCC(C)CCCC(CCCC(CCOC(COP(OCC(N)C(O)=O)(O)=O)(COCCC(CCCC(CCCC(CCCC(C)CCC(C)CCCC(CCCC(C)CCCC(C)CC1)C)C)C)C)[H])C)C)([H])CCC M END
