Mol:EEL0046
Copyright: ARM project http://www.metabolome.jp/
49 48 0 0 0 0 0 0 0 0999 V2000 -8.4445 -0.9477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3458 -0.9592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8246 -0.9623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2134 -0.2086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6024 0.7887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9430 1.5745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0268 -0.3887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2162 0.5830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8033 1.3460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1687 1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4545 1.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0255 1.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6889 1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4035 1.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1179 1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8325 1.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5469 1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2614 1.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9758 1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6903 1.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4047 1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1192 1.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1924 -0.9629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5581 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8436 -0.9456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1293 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5851 -0.9456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2997 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -0.9456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7287 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4431 -0.9456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1578 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8721 -0.9456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5865 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3009 -0.9456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0155 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 -0.9456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4545 0.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4035 0.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2614 0.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1192 0.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8436 -1.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -1.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8721 -1.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 -1.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8338 1.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4445 -0.5331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9333 -0.9579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 4 1 0 4 5 1 0 5 6 1 0 4 8 1 0 4 7 1 0 9 6 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 7 24 1 0 11 39 1 0 15 40 1 0 19 41 1 0 23 42 1 0 26 43 1 0 30 44 1 0 34 45 1 0 38 46 1 0 23 47 1 0 38 48 1 0 1 2 1 0 49 3 1 0 49 2 1 0
A 1 Glc A 2 Glc S SKP 6 ID EEL0046 FORMULA C45H92O3 EXACTMASS 680.70464681 AVERAGEMASS 681.21018 SMILES C(OCCC(CCCC(C)CCCC(C)CCCC(C)C)C)C(COCC)(OCCC(CCCC(C)CCCC(CCCC(C)C)C)C)[H] AUTODRAW FALSE M END
