Mol:FL5FACGL0030
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 53 58 0 0 0 0 0 0 0 0999 V2000 -2.5350 1.2521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 0.4427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 0.0380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1331 0.4427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1331 1.2521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 1.6567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4321 0.0380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2689 0.4427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2689 1.2521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4321 1.6567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4307 -0.7388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9696 1.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 1.2442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3985 1.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3985 2.4816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 2.8941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9696 2.4816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2357 1.6566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9746 0.0118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -0.7711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1972 2.9427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2371 -1.0845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5028 -0.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7357 -1.4758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5028 -2.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2371 -2.7203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0041 -1.9047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2337 -0.3809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5856 -2.2406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -3.4443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 3.7188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6923 -2.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1674 -3.3548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0139 -1.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8055 -2.3586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5543 -1.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8055 -0.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0139 -0.1384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2357 -1.0173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1567 -2.5999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -3.0110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0293 -1.8925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3287 -3.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5371 -3.7188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7882 -2.8399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5371 -1.9556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3287 -1.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0777 -2.3775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0905 -0.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6182 -1.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7263 -1.8168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0166 -3.2773 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 3 4 1 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 1 18 1 0 0 0 0 8 19 1 0 0 0 0 3 20 1 0 0 0 0 21 15 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 1 0 0 0 24 25 1 1 0 0 0 26 25 1 1 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 22 28 1 0 0 0 0 27 29 1 0 0 0 0 26 30 1 0 0 0 0 23 19 1 0 0 0 0 16 31 1 0 0 0 0 25 32 1 0 0 0 0 32 33 1 0 0 0 0 35 34 1 1 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 1 0 0 0 39 34 1 1 0 0 0 39 40 1 0 0 0 0 34 41 1 0 0 0 0 35 42 1 0 0 0 0 36 43 1 0 0 0 0 28 38 1 0 0 0 0 45 44 1 1 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 1 0 0 0 49 44 1 1 0 0 0 48 50 1 0 0 0 0 47 51 1 0 0 0 0 49 52 1 0 0 0 0 44 53 1 0 0 0 0 45 33 1 0 0 0 0 S SKP 5 ID FL5FACGL0030 FORMULA C33H40O20 EXACTMASS 756.21129372 AVERAGEMASS 756.6587 SMILES OC(C6O)C(C(OC6C)OC(C(OC(=C4c(c5)cc(c(c5)O)O)C(=O)c(c(O4)3)c(cc(O)c3)O)1)C(O)C(C(COC(C(O)2)OC(C)C(O)C(O)2)O1)O)O M END