Mol:FL2F1CNP0001
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 26 30 0 0 0 0 0 0 0 0999 V2000 -1.7190 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1627 -1.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6064 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6064 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1627 0.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0501 -1.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5062 -0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5062 -0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0501 0.0230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0623 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6293 -0.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1963 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1963 0.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6293 1.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0623 0.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0501 -1.8055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7631 1.0048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2751 0.0229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6293 1.6594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1627 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7188 0.9862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4473 1.8055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2751 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4404 1.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7631 0.5343 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 14 18 1 0 0 0 0 1 19 1 0 0 0 0 15 20 1 0 0 0 0 6 21 1 0 0 0 0 21 22 2 0 0 0 0 20 23 1 0 0 0 0 23 18 1 0 0 0 0 22 24 1 0 0 0 0 24 19 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 S SKP 8 ID FL2F1CNP0001 KNApSAcK_ID C00008287 NAME Ovaliflavanone B CAS_RN 62868-06-8 FORMULA C21H18O5 EXACTMASS 350.115423686 AVERAGEMASS 350.36462 SMILES O(C1)c(c2)c(ccc(C(C5)Oc(c4C(=O)5)c(c(cc4)3)C=CC(C)(C)O3)2)O1 M END
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