Mol:FL5FACGL0005
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 42 46 0 0 0 0 0 0 0 0999 V2000 -3.2929 1.1429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2929 0.3335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5919 -0.0713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8909 0.3335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8909 1.1429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5919 1.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1899 -0.0713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4889 0.3335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4889 1.1429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1899 1.5476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1899 -0.7024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2119 1.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9264 1.1351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6409 1.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6409 2.3725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9264 2.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2119 2.3725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9937 1.5475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0711 -0.2817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5919 -0.8804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4397 2.8337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4382 -1.3589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2962 -0.9349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0632 -1.7502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2962 -2.5706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4382 -2.9947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2052 -2.1793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4146 -0.7101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -2.6195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3059 -3.4405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2466 -0.3367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8041 -1.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6068 -0.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3815 -0.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8186 -0.1890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1162 -0.5598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1838 -1.0545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1645 -1.1850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9937 -0.4862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9264 3.6097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3073 -3.6097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5671 -3.5828 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 31 32 1 1 0 0 0 32 33 1 1 0 0 0 34 33 1 1 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 31 1 0 0 0 0 32 37 1 0 0 0 0 33 38 1 0 0 0 0 28 31 1 0 0 0 0 34 39 1 0 0 0 0 16 40 1 0 0 0 0 41 42 1 0 0 0 0 25 41 1 0 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 41 42 M SBL 1 1 46 M SMT 1 ^ CH2OH M SBV 1 46 0.0111 1.0392 S SKP 5 ID FL5FACGL0005 FORMULA C26H28O16 EXACTMASS 596.137734848 AVERAGEMASS 596.49092 SMILES c(c5O)c(c(c(c5)1)C(C(OC(C(OC(C4O)OCC(C4O)O)3)OC(CO)C(C3O)O)=C(c(c2)ccc(O)c2O)O1)=O)O M END