Mol:FL5FAGGS0019
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 43 47 0 0 0 0 0 0 0 0999 V2000 -3.1676 -1.1240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4531 -0.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4531 0.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1676 0.5261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8821 0.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8821 -0.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7386 -1.1240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0241 -0.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0241 0.1136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7386 0.5261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2336 0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4612 0.1688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1559 0.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1559 1.3723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4612 1.7733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2336 1.3723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6248 0.5424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1676 -1.8498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7386 -1.7447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4612 2.4336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7707 0.2151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7857 1.7358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3369 -1.1082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4918 -2.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6102 -3.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9153 -2.8420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0382 -2.7245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0802 -1.8475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6147 -2.3955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1222 -3.0224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1673 -3.3982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0838 -3.7300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4293 -3.3351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2256 3.3393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7831 2.5729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6341 2.8161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 2.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9326 3.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0817 3.1150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3742 3.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6248 3.1609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4308 2.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6561 3.7300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 3 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 5 17 1 0 0 0 0 1 18 1 0 0 0 0 7 19 2 0 0 0 0 15 20 1 0 0 0 0 13 21 1 0 0 0 0 14 22 1 0 0 0 0 8 23 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 1 0 0 0 27 26 1 1 0 0 0 28 27 1 1 0 0 0 28 29 1 0 0 0 0 29 24 1 0 0 0 0 23 28 1 0 0 0 0 24 30 1 0 0 0 0 25 31 1 0 0 0 0 26 32 1 0 0 0 0 27 33 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 1 0 0 0 37 36 1 1 0 0 0 38 37 1 1 0 0 0 38 39 1 0 0 0 0 39 34 1 0 0 0 0 22 35 1 0 0 0 0 39 40 1 0 0 0 0 38 41 1 0 0 0 0 37 42 1 0 0 0 0 36 43 1 0 0 0 0 S SKP 5 ID FL5FAGGS0019 FORMULA C27H30O16 EXACTMASS 610.153384912 AVERAGEMASS 610.5175 SMILES c(O2)(c(C(=O)C(OC(C(O)5)OC(C)C(C(O)5)O)=C(c(c4)cc(c(c4O)OC(O3)C(O)C(O)C(O)C(C)3)O)2)1)cc(cc1O)O M END