Mol:FL1DE9GS0001
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 44 47 0 0 0 0 0 0 0 0999 V2000 | + | 44 47 0 0 0 0 0 0 0 0999 V2000 |
− | 0.6030 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6030 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6030 -0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6030 -0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3174 -0.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3174 -0.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0319 -0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0319 -0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0319 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0319 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3174 0.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3174 0.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.7464 -0.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7464 -0.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.4609 -0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4609 -0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.4609 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4609 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.1753 0.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1753 0.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.8898 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8898 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.6043 0.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.6043 0.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.6043 1.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.6043 1.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.8898 1.9457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8898 1.9457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.1753 1.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1753 1.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.7464 -1.7668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7464 -1.7668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6224 0.6367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6224 0.6367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0554 0.6758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0554 0.6758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3174 1.4012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3174 1.4012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6776 1.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6776 1.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3174 -1.6185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3174 -1.6185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6588 -1.9987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6588 -1.9987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.5801 0.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5801 0.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1674 -0.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1674 -0.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3691 0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3691 0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.5756 -0.0298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5756 -0.0298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.9882 0.6849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9882 0.6849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7866 0.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7866 0.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9436 1.0617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9436 1.0617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4234 1.3387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4234 1.3387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.0633 0.2194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0633 0.2194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6161 0.2469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6161 0.2469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5406 -0.4429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5406 -0.4429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -5.1211 1.3626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.1211 1.3626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.7084 0.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.7084 0.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.9101 0.8570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9101 0.8570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.1166 0.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1166 0.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.5292 1.3449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5292 1.3449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.3276 1.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3276 1.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.4846 1.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4846 1.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.9644 1.9987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.9644 1.9987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -5.6043 0.8794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.6043 0.8794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -5.1571 0.9069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.1571 0.9069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.0816 0.2171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0816 0.2171 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 |
− | 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 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
− | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
− | 10 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 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 10 1 0 0 0 0 | + | 15 10 1 0 0 0 0 |
− | 7 16 2 0 0 0 0 | + | 7 16 2 0 0 0 0 |
− | 5 17 1 0 0 0 0 | + | 5 17 1 0 0 0 0 |
− | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
− | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
− | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
− | 3 21 1 0 0 0 0 | + | 3 21 1 0 0 0 0 |
− | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
− | 23 24 1 1 0 0 0 | + | 23 24 1 1 0 0 0 |
− | 24 25 1 1 0 0 0 | + | 24 25 1 1 0 0 0 |
− | 26 25 1 1 0 0 0 | + | 26 25 1 1 0 0 0 |
− | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
− | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
− | 28 23 1 0 0 0 0 | + | 28 23 1 0 0 0 0 |
− | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
− | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
− | 23 31 1 0 0 0 0 | + | 23 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 18 1 0 0 0 0 | + | 26 18 1 0 0 0 0 |
− | 34 35 1 1 0 0 0 | + | 34 35 1 1 0 0 0 |
− | 35 36 1 1 0 0 0 | + | 35 36 1 1 0 0 0 |
− | 37 36 1 1 0 0 0 | + | 37 36 1 1 0 0 0 |
− | 37 38 1 0 0 0 0 | + | 37 38 1 0 0 0 0 |
− | 38 39 1 0 0 0 0 | + | 38 39 1 0 0 0 0 |
− | 39 34 1 0 0 0 0 | + | 39 34 1 0 0 0 0 |
− | 39 40 1 0 0 0 0 | + | 39 40 1 0 0 0 0 |
− | 40 41 1 0 0 0 0 | + | 40 41 1 0 0 0 0 |
− | 34 42 1 0 0 0 0 | + | 34 42 1 0 0 0 0 |
− | 35 43 1 0 0 0 0 | + | 35 43 1 0 0 0 0 |
− | 36 44 1 0 0 0 0 | + | 36 44 1 0 0 0 0 |
− | 37 30 1 0 0 0 0 | + | 37 30 1 0 0 0 0 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL1DE9GS0001 | + | ID FL1DE9GS0001 |
− | KNApSAcK_ID C00014627 | + | KNApSAcK_ID C00014627 |
− | NAME Salicifolioside A;2',4'-Dihydroxy-3',6'-dimethoxydihydrochalcone 4'-glucosyl-(1'''->6'')-glucoside;2',4'-Dihydroxy-3',6'-dimethoxydihydrochalcone 4'-gentiobioside | + | NAME Salicifolioside A;2',4'-Dihydroxy-3',6'-dimethoxydihydrochalcone 4'-glucosyl-(1'''->6'')-glucoside;2',4'-Dihydroxy-3',6'-dimethoxydihydrochalcone 4'-gentiobioside |
− | CAS_RN 243130-37-2 | + | CAS_RN 243130-37-2 |
− | FORMULA C29H38O15 | + | FORMULA C29H38O15 |
− | EXACTMASS 626.221070546 | + | EXACTMASS 626.221070546 |
− | AVERAGEMASS 626.60302 | + | AVERAGEMASS 626.60302 |
− | SMILES c(c3C(=O)CCc(c4)cccc4)(OC)cc(c(c3O)OC)OC(O1)C(C(O)C(C1COC(C(O)2)OC(CO)C(O)C2O)O)O | + | SMILES c(c3C(=O)CCc(c4)cccc4)(OC)cc(c(c3O)OC)OC(O1)C(C(O)C(C1COC(C(O)2)OC(CO)C(O)C2O)O)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 44 47 0 0 0 0 0 0 0 0999 V2000 0.6030 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3174 -0.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0319 -0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0319 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3174 0.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7464 -0.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4609 -0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4609 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1753 0.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8898 0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6043 0.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6043 1.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8898 1.9457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1753 1.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7464 -1.7668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6224 0.6367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0554 0.6758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3174 1.4012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6776 1.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3174 -1.6185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6588 -1.9987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5801 0.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1674 -0.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3691 0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5756 -0.0298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9882 0.6849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7866 0.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9436 1.0617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4234 1.3387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0633 0.2194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6161 0.2469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5406 -0.4429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1211 1.3626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7084 0.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9101 0.8570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1166 0.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5292 1.3449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3276 1.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4846 1.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9644 1.9987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6043 0.8794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1571 0.9069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0816 0.2171 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 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 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 10 1 0 0 0 0 7 16 2 0 0 0 0 5 17 1 0 0 0 0 1 18 1 0 0 0 0 6 19 1 0 0 0 0 19 20 1 0 0 0 0 3 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 1 0 0 0 24 25 1 1 0 0 0 26 25 1 1 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 23 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 23 31 1 0 0 0 0 24 32 1 0 0 0 0 25 33 1 0 0 0 0 26 18 1 0 0 0 0 34 35 1 1 0 0 0 35 36 1 1 0 0 0 37 36 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 34 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 34 42 1 0 0 0 0 35 43 1 0 0 0 0 36 44 1 0 0 0 0 37 30 1 0 0 0 0 S SKP 8 ID FL1DE9GS0001 KNApSAcK_ID C00014627 NAME Salicifolioside A;2',4'-Dihydroxy-3',6'-dimethoxydihydrochalcone 4'-glucosyl-(1'''->6'')-glucoside;2',4'-Dihydroxy-3',6'-dimethoxydihydrochalcone 4'-gentiobioside CAS_RN 243130-37-2 FORMULA C29H38O15 EXACTMASS 626.221070546 AVERAGEMASS 626.60302 SMILES c(c3C(=O)CCc(c4)cccc4)(OC)cc(c(c3O)OC)OC(O1)C(C(O)C(C1COC(C(O)2)OC(CO)C(O)C2O)O)O M END