Mol:BMMCPYUR0012
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 49 52 0 0 1 0 0 0 0 0999 V2000 | + | 49 52 0 0 1 0 0 0 0 0999 V2000 |
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− | 16.1746 -3.2727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 16.1746 -3.2727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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− | 11.2059 2.6887 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 11.2059 2.6887 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 10.3969 2.1009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 10.3969 2.1009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 12.0149 3.2764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 12.0149 3.2764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 11.7937 1.8796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 11.7937 1.8796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 12.7882 1.9842 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 12.7882 1.9842 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 12.8927 0.9896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 12.8927 0.9896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
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− | 13.7827 2.0887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 13.7827 2.0887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 14.3705 1.2797 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 14.3705 1.2797 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
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− | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
− | 43 45 1 0 0 0 0 | + | 43 45 1 0 0 0 0 |
− | 47 49 1 0 0 0 0 | + | 47 49 1 0 0 0 0 |
− | 43 44 2 0 0 0 0 | + | 43 44 2 0 0 0 0 |
− | 47 46 1 0 0 0 0 | + | 47 46 1 0 0 0 0 |
− | 43 42 1 0 0 0 0 | + | 43 42 1 0 0 0 0 |
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− | 17 47 1 0 0 0 0 | + | 17 47 1 0 0 0 0 |
− | 46 43 1 0 0 0 0 | + | 46 43 1 0 0 0 0 |
− | 39 40 2 0 0 0 0 | + | 39 40 2 0 0 0 0 |
− | 39 41 1 0 0 0 0 | + | 39 41 1 0 0 0 0 |
− | 47 48 2 0 0 0 0 | + | 47 48 2 0 0 0 0 |
− | 39 38 1 0 0 0 0 | + | 39 38 1 0 0 0 0 |
− | 12 16 1 6 0 0 0 | + | 12 16 1 6 0 0 0 |
− | 9 16 1 6 0 0 0 | + | 9 16 1 6 0 0 0 |
− | 11 15 1 1 0 0 0 | + | 11 15 1 1 0 0 0 |
− | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
− | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
− | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
− | 3 4 1 0 0 0 0 | + | 3 4 1 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 |
− | 9 1 1 0 0 0 0 | + | 9 1 1 0 0 0 0 |
− | 10 14 1 1 0 0 0 | + | 10 14 1 1 0 0 0 |
− | 2 7 2 0 0 0 0 | + | 2 7 2 0 0 0 0 |
− | 4 8 2 0 0 0 0 | + | 4 8 2 0 0 0 0 |
− | 11 10 1 0 0 0 0 | + | 11 10 1 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
− | 10 9 1 0 0 0 0 | + | 10 9 1 0 0 0 0 |
− | 13 17 1 0 0 0 0 | + | 13 17 1 0 0 0 0 |
− | S SKP 7 | + | S SKP 7 |
− | ID BMMCPYUR0012 | + | ID BMMCPYUR0012 |
− | NAME P1,P4-Bis(5'-uridyl) tetraphosphate | + | NAME P1,P4-Bis(5'-uridyl) tetraphosphate |
− | FORMULA C18H26N4O23P4 | + | FORMULA C18H26N4O23P4 |
− | EXACTMASS 789.9938 | + | EXACTMASS 789.9938 |
− | AVERAGEMASS 790.3072 | + | AVERAGEMASS 790.3072 |
− | SMILES O([C@@H]2COP(OP(OP(OP(OC[C@@H](O3)[C@H]([C@H]([C@@H]3N(C=4)C(=O)NC(=O)C4)O)O)(O)=O)(O)=O)(O)=O)(O)=O)[C@H]([C@@H]([C@@H]2O)O)N(C=1)C(=O)NC(=O)C1 | + | SMILES O([C@@H]2COP(OP(OP(OP(OC[C@@H](O3)[C@H]([C@H]([C@@H]3N(C=4)C(=O)NC(=O)C4)O)O)(O)=O)(O)=O)(O)=O)(O)=O)[C@H]([C@@H]([C@@H]2O)O)N(C=1)C(=O)NC(=O)C1 |
− | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06198 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06198 |
M END | M END | ||
− |
Revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 49 52 0 0 1 0 0 0 0 0999 V2000 17.0406 -2.7727 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.1746 -3.2727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1746 -4.2727 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.0406 -4.7727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9066 -4.2727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9066 -3.2727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3086 -2.7727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0406 -5.7727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0406 -1.7727 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.8496 -1.1849 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.5406 -0.2338 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.5406 -0.2338 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.9528 0.5752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8496 -1.1849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1284 0.5752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2316 -1.1849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9583 0.4707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.1567 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 3.6567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.1567 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.1567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.6567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.1567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 4.6567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.6567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.6567 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5686 4.6512 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5468 4.8591 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0468 3.9931 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0413 4.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8255 5.3203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9535 5.7727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3776 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6291 3.2886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6236 3.3931 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 9.7281 2.3986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5191 4.3877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6181 3.4977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2059 2.6887 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 10.3969 2.1009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0149 3.2764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7937 1.8796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7882 1.9842 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 12.8927 0.9896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6837 2.9787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7827 2.0887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3705 1.2797 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.5615 0.6919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1795 1.8675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22 23 2 0 0 0 0 23 18 1 0 0 0 0 26 18 1 0 0 0 0 27 31 1 6 0 0 0 19 24 2 0 0 0 0 21 25 2 0 0 0 0 28 27 1 0 0 0 0 28 29 1 0 0 0 0 27 26 1 0 0 0 0 30 34 1 0 0 0 0 29 33 1 1 0 0 0 26 33 1 1 0 0 0 28 32 1 6 0 0 0 38 35 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 35 34 1 0 0 0 0 29 30 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 43 45 1 0 0 0 0 47 49 1 0 0 0 0 43 44 2 0 0 0 0 47 46 1 0 0 0 0 43 42 1 0 0 0 0 42 39 1 0 0 0 0 17 47 1 0 0 0 0 46 43 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 47 48 2 0 0 0 0 39 38 1 0 0 0 0 12 16 1 6 0 0 0 9 16 1 6 0 0 0 11 15 1 1 0 0 0 12 13 1 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 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 9 1 1 0 0 0 0 10 14 1 1 0 0 0 2 7 2 0 0 0 0 4 8 2 0 0 0 0 11 10 1 0 0 0 0 11 12 1 0 0 0 0 10 9 1 0 0 0 0 13 17 1 0 0 0 0 S SKP 7 ID BMMCPYUR0012 NAME P1,P4-Bis(5'-uridyl) tetraphosphate FORMULA C18H26N4O23P4 EXACTMASS 789.9938 AVERAGEMASS 790.3072 SMILES O([C@@H]2COP(OP(OP(OP(OC[C@@H](O3)[C@H]([C@H]([C@@H]3N(C=4)C(=O)NC(=O)C4)O)O)(O)=O)(O)=O)(O)=O)(O)=O)[C@H]([C@@H]([C@@H]2O)O)N(C=1)C(=O)NC(=O)C1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06198 M END