Mol:FL3FAANI0007
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 25 27 0 0 0 0 0 0 0 0999 V2000 -2.1416 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1416 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8561 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5706 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5706 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8561 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4272 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7127 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7127 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4272 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0018 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7163 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4307 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4307 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7163 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0018 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4272 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1452 1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8561 -1.8549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1452 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8585 0.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5718 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2850 0.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5718 -0.6174 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 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 1 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 2 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 18 14 1 0 0 0 0 4 19 1 0 0 0 0 6 20 1 0 0 0 0 13 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 S SKP 8 ID FL3FAANI0007 KNApSAcK_ID C00013407 NAME Yinyanghuo D;5,7-Dihydroxy-2-[4-hydroxy-3-(3-methyl-2-butenyl)phenyl]-4H-1-benzopyran-4-one CAS_RN 174286-25-0 FORMULA C20H18O5 EXACTMASS 338.115423686 AVERAGEMASS 338.35392 SMILES c(c1)(C(=C2)Oc(c3)c(c(cc(O)3)O)C(=O)2)cc(c(O)c1)CC=C(C)C M END
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