Mol:FL2FF8GS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 37 40 0 0 0 0 0 0 0 0999 V2000 -0.4310 0.9364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 0.1114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2835 -0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 0.1114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 0.9364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2835 1.3489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7124 1.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2835 -1.1261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1454 1.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8599 0.9364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8599 0.1114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1454 -0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4269 0.9364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1414 1.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1414 2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4269 2.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7124 2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 2.5864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1454 2.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5744 1.3489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1454 -1.1261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8599 2.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 3.4114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6325 -2.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2158 -2.0709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8073 -1.3541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -0.5338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2206 -1.1172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -1.8340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1282 -2.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4269 0.1114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2889 -0.5866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9432 -3.4114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1554 -3.0211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1296 -2.9343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5118 -2.0412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2889 0.9364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 5 7 1 6 0 0 0 3 8 2 0 0 0 0 1 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 2 1 0 0 0 0 7 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 7 1 0 0 0 0 13 31 1 0 0 0 0 17 18 1 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 12 21 1 0 0 0 0 19 22 1 0 0 0 0 18 23 1 0 0 0 0 24 25 1 1 0 0 0 25 26 1 1 0 0 0 27 26 1 1 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 24 1 0 0 0 0 29 30 1 0 0 0 0 27 31 1 0 0 0 0 26 32 1 0 0 0 0 24 33 1 0 0 0 0 25 34 1 0 0 0 0 30 35 1 0 0 0 0 30 36 2 0 0 0 0 20 37 1 0 0 0 0 S SKP 5 ID FL2FF8GS0001 FORMULA C24H26O13 EXACTMASS 522.137340918 AVERAGEMASS 522.45544 SMILES C(C2)(c(c(OC)3)c(OC(O4)C(O)C(O)C(C(C(O)=O)4)O)ccc3)Oc(c(C2=O)1)c(OC)c(cc1O)OC M END