Mol:FL3FRNNR0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 28 31 0 0 0 0 0 0 0 0999 V2000 -1.1734 -1.0729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1734 -0.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8879 0.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8879 -1.4854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4589 -1.4854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2556 -1.0729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2556 -0.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4589 0.1646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4589 -2.1529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6023 -1.0729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6023 -0.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8879 -2.1854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -1.4854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6845 -1.0729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6845 -0.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 0.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.9896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6845 1.4021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 0.9896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3591 1.3423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9691 -0.1646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4018 -1.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4018 -2.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2511 -1.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0413 1.3604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0413 2.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2511 0.1266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 11 2 0 0 0 0 10 4 2 0 0 0 0 4 1 1 0 0 0 0 1 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 2 1 0 0 0 0 5 9 2 0 0 0 0 11 10 1 0 0 0 0 4 12 1 0 0 0 0 6 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 7 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 16 1 0 0 0 0 11 28 1 0 0 0 0 20 21 1 0 0 0 0 18 26 1 0 0 0 0 17 22 1 0 0 0 0 14 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 S SKP 8 ID FL3FRNNR0002 KNApSAcK_ID C00013477 NAME Artoindonesianin T;5,6-Dihydro-1,4,8,10-tetrahydroxy-3-methoxy-5-(1-methylethenyl)-7H-benzo[c]xanthen-7-one CAS_RN 502718-06-1 FORMULA C21H18O7 EXACTMASS 382.10525293 AVERAGEMASS 382.36342 SMILES C(C=13)C(C(C)=C)c(c(O)4)c(c(cc4OC)O)C(Oc(c2)c(C3=O)c(cc(O)2)O)1 M END