Mol:FL1CAANI0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 25 26 0 0 0 0 0 0 0 0999 V2000 2.3281 0.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3281 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8844 -0.3412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4407 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4407 0.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8844 0.9435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0712 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6275 -0.3412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5151 -0.3411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0459 -0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5151 -0.9818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0459 0.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5985 0.9497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1511 0.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1511 -0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5985 -0.3265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5985 -0.9645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 0.9435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4917 0.9410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 0.6635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8944 0.9818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4457 0.6635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 0.9818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4457 0.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7037 0.9497 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 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 16 17 1 0 0 0 0 18 5 1 0 0 0 0 12 19 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 14 25 1 0 0 0 0 20 25 1 0 0 0 0 S SKP 8 ID FL1CAANI0001 KNApSAcK_ID C00007101 NAME 4,2',6'-Trihydroxy-4'-prenyloxychalcone CAS_RN 94393-11-0 FORMULA C20H20O5 EXACTMASS 340.13107375 AVERAGEMASS 340.3698 SMILES Oc(c2)ccc(c2)C=CC(c(c1O)c(cc(c1)OCC=C(C)C)O)=O M END