Mol:FL2FBEGS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 34 37 0 0 0 0 0 0 0 0999 V2000 -1.3085 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3085 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6073 -1.4800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0939 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0939 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6073 0.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7951 -1.4800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4963 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4963 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7951 0.1395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1973 0.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -0.2733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6267 0.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6267 0.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 1.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1973 0.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7951 -2.1653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0095 0.1394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 2.2022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7698 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3435 -0.1023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5186 0.1139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6987 -0.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 0.6180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 0.4019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2417 0.6362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0206 0.0791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2362 -0.3754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2578 0.9350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 1.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3412 1.3771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2417 0.8571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1574 -1.6823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2569 -2.2022 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 1 0 0 0 0 9 10 1 0 0 0 0 10 5 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 7 17 2 0 0 0 0 1 18 1 0 0 0 0 15 19 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 18 23 1 0 0 0 0 20 26 1 0 0 0 0 21 27 1 0 0 0 0 22 28 1 0 0 0 0 29 30 1 0 0 0 0 25 29 1 0 0 0 0 31 32 1 0 0 0 0 14 31 1 0 0 0 0 33 34 1 0 0 0 0 3 33 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 29 30 M SBL 1 1 33 M SMT 1 ^ CH2OH M SBV 1 33 0.3078 -0.5331 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 2 31 32 M SBL 2 1 35 M SMT 2 OCH3 M SBV 2 35 -0.7145 -0.4126 M STY 1 3 SUP M SLB 1 3 3 M SAL 3 2 33 34 M SBL 3 1 37 M SMT 3 ^ OCH3 M SBV 3 37 0.5501 0.2023 S SKP 5 ID FL2FBEGS0001 FORMULA C23H26O11 EXACTMASS 478.147511674 AVERAGEMASS 478.44594 SMILES C(C1O)(C(C(OC1Oc(c4)cc(c(c42)C(CC(c(c3)ccc(c3O)OC)O2)=O)OC)CO)O)O M END