Mol:FL7DECNS0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 23 25 0 0 0 0 0 0 0 0999 V2000 -2.7714 0.3910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7714 -0.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 -0.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3425 -0.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3425 0.3910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 0.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -0.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0864 -0.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0864 0.3910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 0.8035 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 -2.0570 -1.6715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3903 0.7483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7524 0.7755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4669 0.3630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1814 0.7755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1814 1.6005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4669 2.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7524 1.6005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8155 1.9666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4705 -0.8376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6486 -2.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8435 0.4075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4705 1.5955 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 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 3 11 1 0 0 0 0 1 12 1 0 0 0 0 9 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 17 1 0 0 0 0 17 18 2 0 0 0 0 18 13 1 0 0 0 0 16 19 1 0 0 0 0 2 20 1 0 0 0 0 11 21 1 0 0 0 0 15 22 1 0 0 0 0 19 23 1 0 0 0 0 S SKP 8 ID FL7DECNS0002 KNApSAcK_ID C00014870 NAME 5,4'-Dimethyl-6-hydroxyluteolinidin;6,7,3'-Trihydroxy-5,4'-dimethoxy-flavylium CAS_RN - FORMULA C17H17O6 EXACTMASS 317.10251327599997 AVERAGEMASS 317.31327999999996 SMILES COc(c3)c(O)cc(c3)C(C=2)=[O+1]C(=C1)C(C2)C(OC)=C(O)C(O)1 M END