Mol:FL3FALNP0007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 34 0 0 0 0 0 0 0 0999 V2000 -1.9555 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9555 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 -1.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8429 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8429 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 -0.1286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2866 -1.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2697 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2697 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2866 -0.1286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2866 -1.9141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8258 -0.1287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3928 -0.4560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9597 -0.1287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9597 0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3928 0.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8258 0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 -2.0554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5116 -0.1287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8258 -1.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3819 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -1.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9286 -2.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4917 -1.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5116 0.8446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3928 1.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8258 1.8354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2588 1.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2588 0.8533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2705 1.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1115 2.0579 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 3 18 1 0 0 0 0 1 19 1 0 0 0 0 8 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 17 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 S SKP 8 ID FL3FALNP0007 KNApSAcK_ID C00004057 NAME Kuwanon A CAS_RN 62949-77-3 FORMULA C25H24O6 EXACTMASS 420.1572885 AVERAGEMASS 420.45446 SMILES O(c12)C(c(c43)ccc(O)c3C=CC(C)(C)O4)=C(CC=C(C)C)C(=O)c(c(cc(O)c2)O)1 M END