Mol:FL5FACGL0065
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 49 53 0 0 0 0 0 0 0 0999 V2000 -3.0699 0.1707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0699 -0.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3554 -1.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6408 -0.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6408 0.1707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3554 0.5832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9263 -1.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2118 -0.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2118 0.1707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9263 0.5832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9263 -1.7102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6879 0.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4162 0.3216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1443 0.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1443 1.5829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4162 2.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6879 1.5829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3554 -1.8917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9238 2.0328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7321 0.7535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5966 -1.1211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1383 0.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4637 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6777 1.3090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4637 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1383 2.4521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9243 1.7030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8302 2.9841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4637 2.5486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5090 2.1118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7274 0.9397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4162 2.8439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6644 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0209 -1.0099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7684 -1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1549 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4119 -0.7652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8656 -0.6848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7178 -0.2354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3958 -1.1617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7314 -1.7304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7534 -2.4560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0287 -2.9841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3405 -2.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9741 -2.4279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9769 -1.7103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7274 -2.9814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7066 -0.7009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 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 5 1 0 0 0 0 7 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 12 1 0 0 0 0 3 18 1 0 0 0 0 19 15 1 0 0 0 0 4 3 1 0 0 0 0 1 20 1 0 0 0 0 21 8 1 0 0 0 0 23 22 1 1 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 1 0 0 0 27 22 1 1 0 0 0 26 28 1 0 0 0 0 25 29 1 0 0 0 0 27 30 1 0 0 0 0 22 31 1 0 0 0 0 23 20 1 0 0 0 0 16 32 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 1 0 0 0 35 36 1 1 0 0 0 37 36 1 1 0 0 0 37 38 1 0 0 0 0 38 33 1 0 0 0 0 33 39 1 0 0 0 0 38 40 1 0 0 0 0 36 41 1 0 0 0 0 34 21 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 2 0 0 0 0 46 48 1 0 0 0 0 37 49 1 0 0 0 0 S SKP 5 ID FL5FACGL0065 FORMULA C30H32O19 EXACTMASS 696.153778842 AVERAGEMASS 696.56368 SMILES O(CC(O1)C(O)C(O)C(O)C1OC(=C4c(c5)ccc(c5O)O)C(=O)c(c3O4)c(O)cc(c3)OC(C2O)OC(C)C(C(O)2)O)C(CC(O)=O)=O M END