Mol:BMMCPYXXk008
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 24 25 0 0 1 0 0 0 0 0999 V2000 | + | 24 25 0 0 1 0 0 0 0 0999 V2000 |
| − | 5.4791 -0.9307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4791 -0.9307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6131 -1.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6131 -1.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6131 -2.4307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6131 -2.4307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4791 -2.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4791 -2.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3451 -2.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3451 -2.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3451 -1.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3451 -1.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.2331 -0.3407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.2331 -0.3407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7471 -0.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7471 -0.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4791 -3.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4791 -3.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.0991 -0.8407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.0991 -0.8407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.2331 0.6593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.2331 0.6593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4791 0.0693 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.4791 0.0693 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 6.2881 0.6571 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 6.2881 0.6571 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 5.9791 1.6082 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.9791 1.6082 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 4.9791 1.6082 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.9791 1.6082 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 4.3913 2.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3913 2.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.2881 0.6571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.2881 0.6571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.5669 2.4172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.5669 2.4172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6701 0.6571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6701 0.6571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3968 2.3126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3968 2.3126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8090 3.1217 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8090 3.1217 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 2.5339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 2.5339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6180 3.7095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6180 3.7095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2212 3.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2212 3.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 3 2 1 0 0 0 0 | + | 3 2 1 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 1 6 1 0 0 0 0 | + | 1 6 1 0 0 0 0 |
| − | 6 5 2 0 0 0 0 | + | 6 5 2 0 0 0 0 |
| − | 5 4 1 0 0 0 0 | + | 5 4 1 0 0 0 0 |
| − | 4 9 2 0 0 0 0 | + | 4 9 2 0 0 0 0 |
| − | 2 8 2 0 0 0 0 | + | 2 8 2 0 0 0 0 |
| − | 7 10 1 0 0 0 0 | + | 7 10 1 0 0 0 0 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 6 7 1 0 0 0 0 | + | 6 7 1 0 0 0 0 |
| − | 13 12 1 0 0 0 0 | + | 13 12 1 0 0 0 0 |
| − | 12 19 1 6 0 0 0 | + | 12 19 1 6 0 0 0 |
| − | 15 19 1 6 0 0 0 | + | 15 19 1 6 0 0 0 |
| − | 15 14 1 0 0 0 0 | + | 15 14 1 0 0 0 0 |
| − | 14 13 1 0 0 0 0 | + | 14 13 1 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 12 1 1 0 0 0 0 | + | 12 1 1 0 0 0 0 |
| − | 14 18 1 1 0 0 0 | + | 14 18 1 1 0 0 0 |
| − | 13 17 1 1 0 0 0 | + | 13 17 1 1 0 0 0 |
| − | 16 20 1 0 0 0 0 | + | 16 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 21 24 2 0 0 0 0 | + | 21 24 2 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMMCPYXXk008 | + | ID BMMCPYXXk008 |
| − | NAME 5'-Orotidylic acid | + | NAME 5'-Orotidylic acid |
| − | FORMULA C10H13N2O11P | + | FORMULA C10H13N2O11P |
| − | EXACTMASS 368.0256 | + | EXACTMASS 368.0256 |
| − | AVERAGEMASS 368.1908 | + | AVERAGEMASS 368.1908 |
| − | SMILES O=C(N2)C=C(C(O)=O)N(C(=O)2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 | + | SMILES O=C(N2)C=C(C(O)=O)N(C(=O)2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01103 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01103 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
24 25 0 0 1 0 0 0 0 0999 V2000
5.4791 -0.9307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6131 -1.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6131 -2.4307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4791 -2.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3451 -2.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3451 -1.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2331 -0.3407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7471 -0.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4791 -3.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.0991 -0.8407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.2331 0.6593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4791 0.0693 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.2881 0.6571 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.9791 1.6082 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.9791 1.6082 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.3913 2.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2881 0.6571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.5669 2.4172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6701 0.6571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3968 2.3126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8090 3.1217 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.5339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6180 3.7095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2212 3.9307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 4 1 0 0 0 0
3 2 1 0 0 0 0
2 1 1 0 0 0 0
1 6 1 0 0 0 0
6 5 2 0 0 0 0
5 4 1 0 0 0 0
4 9 2 0 0 0 0
2 8 2 0 0 0 0
7 10 1 0 0 0 0
7 11 2 0 0 0 0
6 7 1 0 0 0 0
13 12 1 0 0 0 0
12 19 1 6 0 0 0
15 19 1 6 0 0 0
15 14 1 0 0 0 0
14 13 1 0 0 0 0
15 16 1 0 0 0 0
12 1 1 0 0 0 0
14 18 1 1 0 0 0
13 17 1 1 0 0 0
16 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
21 24 2 0 0 0 0
S SKP 7
ID BMMCPYXXk008
NAME 5'-Orotidylic acid
FORMULA C10H13N2O11P
EXACTMASS 368.0256
AVERAGEMASS 368.1908
SMILES O=C(N2)C=C(C(O)=O)N(C(=O)2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01103
M END
