Mol:FL3FAACS0069
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 38 42 0 0 0 0 0 0 0 0999 V2000 1.8753 1.0617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8753 0.2367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5897 -0.1757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3041 0.2367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3041 1.0617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5897 1.4742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1216 -0.1983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4071 0.2141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3074 -0.1983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3074 -1.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4071 -1.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1216 -1.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0217 0.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7362 -0.1983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7362 -1.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0217 -1.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4073 0.1890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0217 -2.1753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4071 -2.0079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 1.4098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4053 2.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2286 2.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6763 1.7195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5136 0.9104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6902 0.8536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2425 1.4669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8175 2.6153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2286 2.8427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3562 1.9017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3878 -1.8796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8572 -2.5117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7991 -1.6884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3296 -1.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8603 -0.3776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9184 -1.2009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 -1.6375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3299 -2.8427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4109 -2.2428 0.0000 O 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 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 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 10 1 0 0 0 0 14 17 1 0 0 0 0 16 18 1 0 0 0 0 11 19 2 0 0 0 0 5 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 1 0 0 0 24 23 1 1 0 0 0 25 24 1 1 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 21 27 1 0 0 0 0 22 28 1 0 0 0 0 23 29 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 1 0 0 0 33 32 1 1 0 0 0 34 33 1 1 0 0 0 34 35 1 0 0 0 0 35 30 1 0 0 0 0 30 36 1 0 0 0 0 31 37 1 0 0 0 0 32 38 1 0 0 0 0 13 24 1 0 0 0 0 15 33 1 0 0 0 0 S SKP 5 ID FL3FAACS0069 FORMULA C25H26O13 EXACTMASS 534.137340918 AVERAGEMASS 534.46614 SMILES C(O1)C(C(C(C1c(c4O)c(O2)c(c(c4C(C(O)5)OCC(C5O)O)O)C(C=C(c(c3)ccc(c3)O)2)=O)O)O)O M END