Mol:FL1C1LNP0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 30 32 0 0 0 0 0 0 0 0999 V2000 2.0086 0.0656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0086 -0.5768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5649 -0.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1212 -0.5768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1212 0.0656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5649 0.3868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7516 -0.5768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3079 -0.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1955 -0.8978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3654 -0.5642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1955 -1.5386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3654 0.0739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9181 0.3930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4707 0.0739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4707 -0.5642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9181 -0.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5649 -1.5401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6773 0.3867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0233 -0.8832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5746 -0.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1259 -0.8832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6773 -0.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1259 -1.5199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0233 0.3929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9181 -1.5213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9181 1.0570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4932 1.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0682 1.0570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3471 1.5401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6542 1.0570 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 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 2 8 1 0 0 0 0 10 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 10 1 0 0 0 0 3 17 1 0 0 0 0 5 18 1 0 0 0 0 15 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 14 24 1 0 0 0 0 16 25 1 0 0 0 0 13 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 24 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 S SKP 8 ID FL1C1LNP0001 KNApSAcK_ID C00007092 NAME 2,4,2'-Trihydroxy-6'',6''-dimethyl-3'-prenylpyrano[2'',3'':4',5']chalcone CAS_RN 50773-29-0 FORMULA C25H26O5 EXACTMASS 406.178023942 AVERAGEMASS 406.47094 SMILES CC(C)(O1)C=Cc(c2)c1c(c(O)c2C(=O)C=Cc(c3)c(O)cc(c3)O)CC=C(C)C M END