Mol:FL3FABGS0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 34 37 0 0 0 0 0 0 0 0999 V2000 -1.0227 0.1018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0227 -0.7077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3217 -1.1124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3794 -0.7077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3794 0.1018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3217 0.5067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0806 -1.1124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7815 -0.7077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7815 0.1018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0806 0.5067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0806 -1.7436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4823 0.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1968 0.0939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9115 0.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9115 1.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1968 1.7440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4823 1.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7235 0.5065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3217 -1.7440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9503 0.6026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3092 -0.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 0.1153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4952 0.1249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1425 0.7724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0855 0.4337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7362 0.3213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1216 -0.1907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6278 1.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5186 -0.4838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2772 1.7287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5963 1.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3524 1.1100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6257 1.7439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7362 1.1027 0.0000 C 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 19 3 1 0 0 0 0 20 21 1 1 0 0 0 21 22 1 1 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 20 1 0 0 0 0 20 26 1 0 0 0 0 21 27 1 0 0 0 0 25 28 1 0 0 0 0 22 29 1 0 0 0 0 23 18 1 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 28 32 2 0 0 0 0 33 34 1 0 0 0 0 15 33 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 33 34 M SBL 1 1 37 M SMT 1 OCH3 M SBV 1 37 -0.7142 -0.4123 S SKP 5 ID FL3FABGS0004 FORMULA C23H22O11 EXACTMASS 474.116211546 AVERAGEMASS 474.41418000000004 SMILES c(c1C(O2)=CC(c(c4O)c(cc(c4)OC(O3)C(O)C(C(O)C3C(OC)=O)O)2)=O)cc(OC)cc1 M END