Mol:BMMCPD--S501
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 18 19 0 0 1 0 0 0 0 0999 V2000 | + | 18 19 0 0 1 0 0 0 0 0999 V2000 |
| − | 4.5981 -0.1739 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -0.1739 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 -1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 0.8261 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.5981 0.8261 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 5.4071 1.4139 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.4071 1.4139 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 5.0981 2.3649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.0981 2.3649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 4.0981 2.3649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.0981 2.3649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 3.5103 3.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5103 3.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -1.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -1.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.4071 1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.4071 1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.6859 3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.6859 3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7891 1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7891 1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5158 3.0694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5158 3.0694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 12 18 1 0 0 0 0 | + | 12 18 1 0 0 0 0 |
| − | 11 17 1 6 0 0 0 | + | 11 17 1 6 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 |
| − | 10 16 1 1 0 0 0 | + | 10 16 1 1 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 |
| − | 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 |
| − | 9 8 1 0 0 0 0 | + | 9 8 1 0 0 0 0 |
| − | 3 7 1 0 0 0 0 | + | 3 7 1 0 0 0 0 |
| − | 9 15 1 1 0 0 0 | + | 9 15 1 1 0 0 0 |
| − | 7 14 2 0 0 0 0 | + | 7 14 2 0 0 0 0 |
| − | 8 17 1 6 0 0 0 | + | 8 17 1 6 0 0 0 |
| − | 7 13 1 0 0 0 0 | + | 7 13 1 0 0 0 0 |
| − | 8 1 1 0 0 0 0 | + | 8 1 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMMCPD--S501 | + | ID BMMCPD--S501 |
| − | NAME Nicotinate D-ribonucleoside | + | NAME Nicotinate D-ribonucleoside |
| − | FORMULA C11H14NO6 | + | FORMULA C11H14NO6 |
| − | EXACTMASS 256.0821 | + | EXACTMASS 256.0821 |
| − | AVERAGEMASS 256.232 | + | AVERAGEMASS 256.232 |
| − | SMILES OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1[n+1](c2)cc(cc2)C(O)=O | + | SMILES OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1[n+1](c2)cc(cc2)C(O)=O |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05841 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05841 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
18 19 0 0 1 0 0 0 0 0999 V2000
4.5981 -0.1739 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
3.7321 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.8261 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.4071 1.4139 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.0981 2.3649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.0981 2.3649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.5103 3.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.4071 1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6859 3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7891 1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5158 3.0694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
12 18 1 0 0 0 0
11 17 1 6 0 0 0
11 10 1 0 0 0 0
11 12 1 0 0 0 0
10 9 1 0 0 0 0
10 16 1 1 0 0 0
5 6 2 0 0 0 0
6 1 1 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
9 8 1 0 0 0 0
3 7 1 0 0 0 0
9 15 1 1 0 0 0
7 14 2 0 0 0 0
8 17 1 6 0 0 0
7 13 1 0 0 0 0
8 1 1 0 0 0 0
S SKP 7
ID BMMCPD--S501
NAME Nicotinate D-ribonucleoside
FORMULA C11H14NO6
EXACTMASS 256.0821
AVERAGEMASS 256.232
SMILES OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1[n+1](c2)cc(cc2)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05841
M END
