Mol:FL5FEAGS0023
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 34 37 0 0 0 0 0 0 0 0999 V2000 | + | 34 37 0 0 0 0 0 0 0 0999 V2000 |
− | 2.3678 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3678 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.3678 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3678 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.0823 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0823 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7968 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7968 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7968 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7968 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.0823 1.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0823 1.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.6534 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6534 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.9389 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9389 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2244 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2244 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.2244 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2244 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.9389 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9389 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.6534 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6534 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.4901 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4901 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2045 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2045 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2045 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2045 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.4901 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4901 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.9389 -1.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9389 -1.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9190 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9190 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.3310 -1.1069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3310 -1.1069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.3975 1.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3975 1.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.4901 -1.7842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4901 -1.7842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.8707 -1.0567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8707 -1.0567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.0902 1.3373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0902 1.3373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.6070 0.6357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6070 0.6357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.1944 -0.0790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1944 -0.0790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.3960 0.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3960 0.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6025 -0.0967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6025 -0.0967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.0151 0.6181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0151 0.6181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.8135 0.4090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8135 0.4090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.9705 0.9948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9705 0.9948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.4503 1.2719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4503 1.2719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -5.0902 0.1525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.0902 0.1525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.6430 0.1801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6430 0.1801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.5675 -0.5098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5675 -0.5098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
− | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
− | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
− | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
− | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
− | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
− | 2 7 1 0 0 0 0 | + | 2 7 1 0 0 0 0 |
− | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
− | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
− | 9 10 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
− | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
− | 12 7 2 0 0 0 0 | + | 12 7 2 0 0 0 0 |
− | 9 13 1 0 0 0 0 | + | 9 13 1 0 0 0 0 |
− | 13 14 2 0 0 0 0 | + | 13 14 2 0 0 0 0 |
− | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
− | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
− | 16 10 1 0 0 0 0 | + | 16 10 1 0 0 0 0 |
− | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
− | 11 17 2 0 0 0 0 | + | 11 17 2 0 0 0 0 |
− | 12 19 1 0 0 0 0 | + | 12 19 1 0 0 0 0 |
− | 5 20 1 0 0 0 0 | + | 5 20 1 0 0 0 0 |
− | 16 21 1 0 0 0 0 | + | 16 21 1 0 0 0 0 |
− | 15 22 1 0 0 0 0 | + | 15 22 1 0 0 0 0 |
− | 20 23 1 0 0 0 0 | + | 20 23 1 0 0 0 0 |
− | 24 25 1 1 0 0 0 | + | 24 25 1 1 0 0 0 |
− | 25 26 1 1 0 0 0 | + | 25 26 1 1 0 0 0 |
− | 27 26 1 1 0 0 0 | + | 27 26 1 1 0 0 0 |
− | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
− | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
− | 29 24 1 0 0 0 0 | + | 29 24 1 0 0 0 0 |
− | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
− | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
− | 24 32 1 0 0 0 0 | + | 24 32 1 0 0 0 0 |
− | 25 33 1 0 0 0 0 | + | 25 33 1 0 0 0 0 |
− | 26 34 1 0 0 0 0 | + | 26 34 1 0 0 0 0 |
− | 27 18 1 0 0 0 0 | + | 27 18 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL5FEAGS0023 | + | ID FL5FEAGS0023 |
− | KNApSAcK_ID C00013826 | + | KNApSAcK_ID C00013826 |
− | NAME 6-Hydroxykaempferol 4'-methyl ether 7-glucoside;3,5,6-Trihydroxy-4'-methoxyflavone-7-beta-D-glucoside;7-(beta-D-Glucopyranosyloxy)-3,5,6-trihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one | + | NAME 6-Hydroxykaempferol 4'-methyl ether 7-glucoside;3,5,6-Trihydroxy-4'-methoxyflavone-7-beta-D-glucoside;7-(beta-D-Glucopyranosyloxy)-3,5,6-trihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one |
− | CAS_RN 349607-67-6 | + | CAS_RN 349607-67-6 |
− | FORMULA C22H22O12 | + | FORMULA C22H22O12 |
− | EXACTMASS 478.111126168 | + | EXACTMASS 478.111126168 |
− | AVERAGEMASS 478.40288000000004 | + | AVERAGEMASS 478.40288000000004 |
− | SMILES O(C)c(c4)ccc(c4)C(=C(O)1)Oc(c2)c(c(O)c(O)c2OC(C(O)3)OC(CO)C(C3O)O)C1=O | + | SMILES O(C)c(c4)ccc(c4)C(=C(O)1)Oc(c2)c(c(O)c(O)c2OC(C(O)3)OC(CO)C(C3O)O)C1=O |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 34 37 0 0 0 0 0 0 0 0999 V2000 2.3678 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3678 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0823 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7968 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7968 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0823 1.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6534 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9389 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2244 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2244 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9389 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6534 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4901 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2045 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2045 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4901 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9389 -1.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -1.1069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3975 1.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4901 -1.7842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8707 -1.0567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0902 1.3373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6070 0.6357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1944 -0.0790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 0.1302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6025 -0.0967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0151 0.6181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8135 0.4090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9705 0.9948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4503 1.2719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0902 0.1525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 0.1801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5675 -0.5098 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 4 2 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 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 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 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 12 19 1 0 0 0 0 5 20 1 0 0 0 0 16 21 1 0 0 0 0 15 22 1 0 0 0 0 20 23 1 0 0 0 0 24 25 1 1 0 0 0 25 26 1 1 0 0 0 27 26 1 1 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 24 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 24 32 1 0 0 0 0 25 33 1 0 0 0 0 26 34 1 0 0 0 0 27 18 1 0 0 0 0 S SKP 8 ID FL5FEAGS0023 KNApSAcK_ID C00013826 NAME 6-Hydroxykaempferol 4'-methyl ether 7-glucoside;3,5,6-Trihydroxy-4'-methoxyflavone-7-beta-D-glucoside;7-(beta-D-Glucopyranosyloxy)-3,5,6-trihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one CAS_RN 349607-67-6 FORMULA C22H22O12 EXACTMASS 478.111126168 AVERAGEMASS 478.40288000000004 SMILES O(C)c(c4)ccc(c4)C(=C(O)1)Oc(c2)c(c(O)c(O)c2OC(C(O)3)OC(CO)C(C3O)O)C1=O M END