Mol:FL3FACNSS001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 25 27 0 0 0 0 0 0 0 0999 V2000 -0.7865 -0.1432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7865 -0.6640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3354 -0.9244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1156 -0.6640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1156 -0.1432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3354 0.1173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5667 -0.9244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0178 -0.6640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0178 -0.1432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5667 0.1173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5667 -1.3305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4687 0.1172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9284 -0.1483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3881 0.1172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3881 0.6480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9284 0.9134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4687 0.6480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 0.1568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3354 -1.4442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9824 0.9911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2006 0.1568 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2006 0.8778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2006 -0.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9824 0.1568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9284 1.4442 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 7 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 12 1 0 0 0 0 18 1 1 0 0 0 0 3 19 1 0 0 0 0 15 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 16 25 1 0 0 0 0 S SKP 8 ID FL3FACNSS001 KNApSAcK_ID C00004328 NAME Luteolin 7-sulfate CAS_RN 56857-57-9 FORMULA C15H10O9S EXACTMASS 366.00455260800004 AVERAGEMASS 366.30050000000006 SMILES Oc(c3)c(O)cc(c3)C(=C2)Oc(c1)c(C(=O)2)c(O)cc1OS(O)(=O)=O M END