Mol:FL1CBANI0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 32 0 0 0 0 0 0 0 0999 V2000 -1.7862 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 2.2688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9296 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9296 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6441 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 2.2688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 2.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2151 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9296 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9296 2.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6441 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 -1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 -2.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 -2.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -2.6812 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 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 10 2 0 0 0 0 10 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 14 17 1 0 0 0 0 6 18 1 0 0 0 0 18 19 1 0 0 0 0 4 20 1 0 0 0 0 2 21 1 0 0 0 0 1 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 3 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 FL1CBANI0003 KNApSAcK_ID C00014473 NAME 5'-Prenylxanthohumol;3',5'-Diprenyl-4,2',4'-trihydroxy-6-methoxychalcone CAS_RN 189299-04-5 FORMULA C26H30O5 EXACTMASS 422.20932407 AVERAGEMASS 422.5134 SMILES Oc(c1)ccc(C=CC(c(c2O)c(OC)c(CC=C(C)C)c(c2CC=C(C)C)O)=O)c1 M END