Mol:FL3FALNI0007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 33 0 0 0 0 0 0 0 0999 V2000 -1.9623 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9623 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8497 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8497 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2934 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2629 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2629 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2934 -0.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2934 -2.2938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9529 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9529 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 0.4737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5184 -0.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4664 0.3810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.4351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2522 0.4736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -1.7929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3751 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -1.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4849 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -2.4329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9528 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9528 2.1085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3872 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5184 2.4351 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 1 18 1 0 0 0 0 19 15 1 0 0 0 0 3 20 1 0 0 0 0 17 21 1 0 0 0 0 8 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 16 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 S SKP 8 ID FL3FALNI0007 KNApSAcK_ID C00004030 NAME Kuwanon T;2-[2,4-Dihydroxy-3-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-3-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one CAS_RN 100187-66-4 FORMULA C25H26O6 EXACTMASS 422.172938564 AVERAGEMASS 422.47033999999996 SMILES c(c(C(=C(CC=C(C)C)3)Oc(c2C(=O)3)cc(cc2O)O)1)cc(c(CC=C(C)C)c1O)O M END