Mol:FLIC1LNF0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 24 27 0 0 0 0 0 0 0 0999 V2000 -1.4672 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4672 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9109 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3546 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3546 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9109 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2017 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2017 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3141 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3141 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9089 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5036 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5036 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9089 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9089 0.9023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0978 -1.1571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0782 1.0347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4557 0.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0782 -0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0978 0.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4433 -0.6372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7225 -0.6206 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 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 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 16 17 1 0 0 0 0 14 18 1 0 0 0 0 1 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 2 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 S SKP 8 ID FLIC1LNF0002 KNApSAcK_ID C00010034 NAME Cyclomillinol;(3R)-2'',3''-Dihydro-2'',3'',3''-trimethyl-2',4'-dihydroxyfurano[4'',5'':6,7]isoflavan CAS_RN 121747-87-3 FORMULA C20H22O4 EXACTMASS 326.151809192 AVERAGEMASS 326.38628 SMILES c(c1)(C(C4)Cc(c(O4)3)cc(c2c3)C(C(C)O2)(C)C)c(O)cc(O)c1 M END