Mol:BMCCPUXA0001
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 25 0 0 1 0 0 0 0 0999 V2000 | + | 22 25 0 0 1 0 0 0 0 0999 V2000 |
− | 3.7321 3.2803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 3.2803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 2.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 2.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 1.7803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.7803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 1.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 1.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 1.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 1.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 2.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 2.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.1229 1.1112 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1229 1.1112 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5296 0.1976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5296 0.1976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.5241 0.3022 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5241 0.3022 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 3.2803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 3.2803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.1933 -0.4410 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.1933 -0.4410 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 5.1878 -0.3365 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.1878 -0.3365 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 5.5945 -1.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.5945 -1.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 4.8514 -1.9191 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.8514 -1.9191 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 5.0593 -2.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0593 -2.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.6878 0.5296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.6878 0.5296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6.5456 -1.5590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.5456 -1.5590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.9854 -1.4191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9854 -1.4191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6.0104 -3.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.0104 -3.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6.7535 -2.5372 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.7535 -2.5372 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 7.4226 -3.2803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.4226 -3.2803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 7.7316 -2.3293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.7316 -2.3293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
− | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
− | 11 9 1 0 0 0 0 | + | 11 9 1 0 0 0 0 |
− | 9 4 1 0 0 0 0 | + | 9 4 1 0 0 0 0 |
− | 9 8 1 0 0 0 0 | + | 9 8 1 0 0 0 0 |
− | 12 11 1 0 0 0 0 | + | 12 11 1 0 0 0 0 |
− | 11 18 1 1 0 0 0 | + | 11 18 1 1 0 0 0 |
− | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
− | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
− | 8 7 2 0 0 0 0 | + | 8 7 2 0 0 0 0 |
− | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
− | 14 18 1 1 0 0 0 | + | 14 18 1 1 0 0 0 |
− | 12 16 1 6 0 0 0 | + | 12 16 1 6 0 0 0 |
− | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
− | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
− | 15 19 1 0 0 0 0 | + | 15 19 1 0 0 0 0 |
− | 3 2 2 0 0 0 0 | + | 3 2 2 0 0 0 0 |
− | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
− | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
− | 20 17 1 0 0 0 0 | + | 20 17 1 0 0 0 0 |
− | 13 17 1 6 0 0 0 | + | 13 17 1 6 0 0 0 |
− | 6 10 2 0 0 0 0 | + | 6 10 2 0 0 0 0 |
− | 20 21 2 0 0 0 0 | + | 20 21 2 0 0 0 0 |
− | 5 7 1 0 0 0 0 | + | 5 7 1 0 0 0 0 |
− | 20 22 1 0 0 0 0 | + | 20 22 1 0 0 0 0 |
− | S SKP 7 | + | S SKP 7 |
− | ID BMCCPUXA0001 | + | ID BMCCPUXA0001 |
− | NAME 3',5'-Cyclic IMP | + | NAME 3',5'-Cyclic IMP |
− | FORMULA C10H11N4O7P | + | FORMULA C10H11N4O7P |
− | EXACTMASS 330.0365 | + | EXACTMASS 330.0365 |
− | AVERAGEMASS 330.1908 | + | AVERAGEMASS 330.1908 |
− | SMILES O=C(N4)c(n3)c(N=C4)n(c3)[C@H](O1)[C@H](O)[C@H](O2)[C@@H](COP(O)(=O)2)1 | + | SMILES O=C(N4)c(n3)c(N=C4)n(c3)[C@H](O1)[C@H](O)[C@H](O2)[C@@H](COP(O)(=O)2)1 |
− | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00943 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00943 |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 22 25 0 0 1 0 0 0 0 0999 V2000 3.7321 3.2803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1229 1.1112 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5296 0.1976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5241 0.3022 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1933 -0.4410 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1878 -0.3365 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5945 -1.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8514 -1.9191 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0593 -2.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6878 0.5296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5456 -1.5590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9854 -1.4191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0104 -3.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7535 -2.5372 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 7.4226 -3.2803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7316 -2.3293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13 14 1 0 0 0 0 2 1 1 0 0 0 0 11 9 1 0 0 0 0 9 4 1 0 0 0 0 9 8 1 0 0 0 0 12 11 1 0 0 0 0 11 18 1 1 0 0 0 4 5 2 0 0 0 0 4 3 1 0 0 0 0 8 7 2 0 0 0 0 12 13 1 0 0 0 0 14 18 1 1 0 0 0 12 16 1 6 0 0 0 14 15 1 0 0 0 0 5 6 1 0 0 0 0 15 19 1 0 0 0 0 3 2 2 0 0 0 0 19 20 1 0 0 0 0 6 1 1 0 0 0 0 20 17 1 0 0 0 0 13 17 1 6 0 0 0 6 10 2 0 0 0 0 20 21 2 0 0 0 0 5 7 1 0 0 0 0 20 22 1 0 0 0 0 S SKP 7 ID BMCCPUXA0001 NAME 3',5'-Cyclic IMP FORMULA C10H11N4O7P EXACTMASS 330.0365 AVERAGEMASS 330.1908 SMILES O=C(N4)c(n3)c(N=C4)n(c3)[C@H](O1)[C@H](O)[C@H](O2)[C@@H](COP(O)(=O)2)1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00943 M END