Mol:FL3FALNP0011
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 32 35 0 0 0 0 0 0 0 0999 V2000 -2.2507 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2507 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6944 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1381 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1381 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6944 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5818 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0255 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0255 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5818 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5818 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5306 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0976 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6645 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6645 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0976 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5306 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1781 1.0345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6944 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3633 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3633 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9194 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3633 0.4662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2535 -0.1494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8096 0.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3645 -0.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9194 0.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3645 -0.7894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0976 -0.8367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0976 1.7816 0.0000 O 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 18 15 1 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 2 1 0 0 0 0 21 24 1 0 0 0 0 21 25 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 26 14 1 0 0 0 0 13 31 1 0 0 0 0 16 32 1 0 0 0 0 S SKP 8 ID FL3FALNP0011 KNApSAcK_ID C00004066 NAME Artobilichromene CAS_RN 54963-50-7 FORMULA C25H24O7 EXACTMASS 436.152203122 AVERAGEMASS 436.45385999999996 SMILES C(C)(C)=CCc(c1O)c(O)c(O)cc(C(=C2)Oc(c4)c(c(O)c(c43)C=CC(O3)(C)C)C2=O)1 M END