Mol:FLNAA9NF0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 34 0 0 0 0 0 0 0 0999 V2000 -0.3924 0.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1639 0.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 0.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -0.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2968 -0.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8735 -0.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8735 0.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2968 0.7172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3924 -0.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1639 -0.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2968 -1.2802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7438 -1.5995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7438 -2.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2968 -2.5572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8497 -2.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8497 -1.5995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4498 0.7170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1639 -1.1278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5043 -0.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9485 -0.5787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9771 -0.5309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9485 -1.2335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0304 1.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6085 1.4007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8697 0.8139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9295 1.9568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6085 2.5129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5716 1.9568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2761 2.5572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4498 -0.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9771 -1.0767 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 7 1 0 0 0 0 7 8 1 0 0 0 0 8 3 1 0 0 0 0 1 9 1 0 0 0 0 9 10 2 0 0 0 0 10 4 1 0 0 0 0 5 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 10 18 1 0 0 0 0 19 20 1 0 0 0 0 20 9 1 0 0 0 0 19 21 1 0 0 0 0 20 22 2 0 0 0 0 2 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 1 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 21 30 1 0 0 0 0 21 31 1 0 0 0 0 S SKP 8 ID FLNAA9NF0001 KNApSAcK_ID C00010224 NAME 1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(3-methylbutyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one CAS_RN 30563-62-3 FORMULA C25H26O6 EXACTMASS 422.172938564 AVERAGEMASS 422.47033999999996 SMILES c(c12)(c(C(=O)CC(C)C)c(c(C(c(c4)cccc4)=3)c2OC(=O)C3)O)OC(C(C)(C)O)C1 M END