Mol:FL3FAANP0006
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 25 28 0 0 0 0 0 0 0 0999 V2000 -1.8352 -0.8001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8352 0.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5496 0.4374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2641 0.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2641 -0.8001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5496 -1.2126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1207 -1.2126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4062 -0.8001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4062 0.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1207 0.4374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3082 0.4374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0227 0.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7372 0.4374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7372 1.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0227 1.6749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3082 1.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1207 -2.0376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5496 -2.0376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9786 0.4374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4516 0.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1661 0.4374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1661 1.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4516 1.6749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9786 1.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4483 2.0376 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 6 18 1 0 0 0 0 4 19 1 0 0 0 0 13 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 14 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 S SKP 8 ID FL3FAANP0006 KNApSAcK_ID C00013431 NAME Yinyanghuo C;2-(2,2-Dimethyl-2H-1-benzopyran-6-yl)-5,7-dihydroxy-4H-1-benzopyran-4-one CAS_RN 149182-47-8 FORMULA C20H16O5 EXACTMASS 336.099773622 AVERAGEMASS 336.33804000000003 SMILES c(c12)(ccc(C(=C3)Oc(c4)c(c(cc(O)4)O)C(=O)3)c2)OC(C=C1)(C)C M END