Mol:FL5FA9NS0006
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 22 24 0 0 0 0 0 0 0 0999 V2000 | + | 22 24 0 0 0 0 0 0 0 0999 V2000 |
− | -1.7790 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7790 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7790 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7790 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2227 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2227 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.6664 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6664 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.6664 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6664 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2227 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2227 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.1101 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1101 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4462 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4462 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4462 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4462 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.1101 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1101 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.1101 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1101 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0023 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0023 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.5693 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5693 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.1362 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1362 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.1362 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1362 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.5693 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5693 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0023 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0023 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2227 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2227 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1362 0.7700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1362 0.7700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6362 1.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6362 1.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3122 -0.9911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3122 -0.9911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.1782 -1.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1782 -1.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
− | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
− | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
− | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
− | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
− | 6 1 2 0 0 0 0 | + | 6 1 2 0 0 0 0 |
− | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
− | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
− | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
− | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
− | 10 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
− | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
− | 9 12 1 0 0 0 0 | + | 9 12 1 0 0 0 0 |
− | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
− | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
− | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
− | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
− | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
− | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
− | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
− | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
− | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
− | 8 21 1 0 0 0 0 | + | 8 21 1 0 0 0 0 |
− | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
− | M STY 1 2 SUP | + | M STY 1 2 SUP |
− | M SLB 1 2 2 | + | M SLB 1 2 2 |
− | M SAL 2 2 21 22 | + | M SAL 2 2 21 22 |
− | M SBL 2 1 23 | + | M SBL 2 1 23 |
− | M SMT 2 OCH3 | + | M SMT 2 OCH3 |
− | M SVB 2 23 0.6451 -0.6973 | + | M SVB 2 23 0.6451 -0.6973 |
− | M STY 1 1 SUP | + | M STY 1 1 SUP |
− | M SLB 1 1 1 | + | M SLB 1 1 1 |
− | M SAL 1 2 19 20 | + | M SAL 1 2 19 20 |
− | M SBL 1 1 21 | + | M SBL 1 1 21 |
− | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
− | M SVB 1 21 -2.1362 0.77 | + | M SVB 1 21 -2.1362 0.77 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL5FA9NS0006 | + | ID FL5FA9NS0006 |
− | KNApSAcK_ID C00004537 | + | KNApSAcK_ID C00004537 |
− | NAME Galangin 3,7-dimethyl ether;3,7-Dimethoxy-5-hydroxyflavone;3,7-Dimethylgalangin;5-Hydroxy-3,7-dimethoxy-2-phenyl-4H-1-benzopyran-4-one | + | NAME Galangin 3,7-dimethyl ether;3,7-Dimethoxy-5-hydroxyflavone;3,7-Dimethylgalangin;5-Hydroxy-3,7-dimethoxy-2-phenyl-4H-1-benzopyran-4-one |
− | CAS_RN 70786-48-0 | + | CAS_RN 70786-48-0 |
− | FORMULA C17H14O5 | + | FORMULA C17H14O5 |
− | EXACTMASS 298.084123558 | + | EXACTMASS 298.084123558 |
− | AVERAGEMASS 298.29006 | + | AVERAGEMASS 298.29006 |
− | SMILES COc(c3)cc(O1)c(c(O)3)C(=O)C(OC)=C1c(c2)cccc2 | + | SMILES COc(c3)cc(O1)c(c(O)3)C(=O)C(OC)=C1c(c2)cccc2 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 22 24 0 0 0 0 0 0 0 0999 V2000 -1.7790 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2227 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6664 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6664 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2227 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1101 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4462 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4462 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1101 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1101 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0023 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5693 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1362 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1362 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5693 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0023 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2227 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1362 0.7700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6362 1.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3122 -0.9911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1782 -1.4911 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 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 3 18 1 0 0 0 0 1 19 1 0 0 0 0 19 20 1 0 0 0 0 8 21 1 0 0 0 0 21 22 1 0 0 0 0 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 2 21 22 M SBL 2 1 23 M SMT 2 OCH3 M SVB 2 23 0.6451 -0.6973 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 19 20 M SBL 1 1 21 M SMT 1 OCH3 M SVB 1 21 -2.1362 0.77 S SKP 8 ID FL5FA9NS0006 KNApSAcK_ID C00004537 NAME Galangin 3,7-dimethyl ether;3,7-Dimethoxy-5-hydroxyflavone;3,7-Dimethylgalangin;5-Hydroxy-3,7-dimethoxy-2-phenyl-4H-1-benzopyran-4-one CAS_RN 70786-48-0 FORMULA C17H14O5 EXACTMASS 298.084123558 AVERAGEMASS 298.29006 SMILES COc(c3)cc(O1)c(c(O)3)C(=O)C(OC)=C1c(c2)cccc2 M END