Mol:FLIAAANF0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 26 29 0 0 0 0 0 0 0 0999 V2000 -1.1469 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1469 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5906 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0343 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0343 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5906 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5221 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0784 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0784 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5221 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6344 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6344 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2292 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2292 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5221 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5906 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4182 -1.1571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7578 1.0347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1353 0.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7578 -0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7775 0.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0985 1.0711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0985 -0.0411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4182 0.5150 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 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 7 17 2 0 0 0 0 3 18 1 0 0 0 0 14 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 2 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 S SKP 8 ID FLIAAANF0001 KNApSAcK_ID C00009501 NAME Erythrinin C CAS_RN 63807-85-2 FORMULA C20H18O6 EXACTMASS 354.110338308 AVERAGEMASS 354.35332 SMILES Oc(c1)ccc(C(=C4)C(c(c(O4)3)c(O)c(c2c3)CC(C(C)(C)O)O2)=O)c1 M END