Mol:FLIDHXNS0010
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 23 27 0 0 0 0 0 0 0 0999 V2000 -2.2357 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2357 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6794 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1231 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1231 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6794 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5668 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0105 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0105 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5668 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5456 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5456 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1404 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7352 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7352 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1404 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -0.8138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5429 0.5133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3883 -1.0262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3883 0.0850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1404 0.9023 0.0000 O 0 0 0 0 0 0 0 0 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 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 8 11 1 0 0 0 0 11 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 11 2 0 0 0 0 7 17 1 0 0 0 0 1 2 1 0 0 0 0 12 17 1 0 0 0 0 1 18 1 0 0 0 0 8 19 1 0 0 0 0 14 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 15 1 0 0 0 0 16 23 1 0 0 0 0 S SKP 8 ID FLIDHXNS0010 KNApSAcK_ID C00009679 NAME 6a,7-Dihydroxymaackiain;3,6a,7-Trihydroxy-8,9-methylenedioxypterocarpan CAS_RN 61135-99-7 FORMULA C16H12O7 EXACTMASS 316.058302738 AVERAGEMASS 316.26228000000003 SMILES Oc(c5)cc(O4)c(c5)C(O1)C(O)(C4)c(c(O)2)c(cc(O3)c(OC3)2)1 M END