Mol:BMSUM6N0--08
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 12 12 0 0 1 0 0 0 0 0999 V2000 | + | 12 12 0 0 1 0 0 0 0 0999 V2000 |
| − | 3.7321 1.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 3.7321 1.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 2.8660 0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -1.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 3.7321 -1.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 4.5981 -0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 4.5981 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 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 11 1 6 0 0 0 | + | 5 11 1 6 0 0 0 |
| − | 1 7 1 6 0 0 0 | + | 1 7 1 6 0 0 0 |
| − | 2 8 1 1 0 0 0 | + | 2 8 1 1 0 0 0 |
| − | 3 9 1 6 0 0 0 | + | 3 9 1 6 0 0 0 |
| − | 4 10 1 1 0 0 0 | + | 4 10 1 1 0 0 0 |
| − | 6 12 1 1 0 0 0 | + | 6 12 1 1 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMSUM6N0--08 | + | ID BMSUM6N0--08 |
| − | NAME Streptamine | + | NAME Streptamine |
| − | FORMULA C6H14N2O4 | + | FORMULA C6H14N2O4 |
| − | EXACTMASS 178.0953 | + | EXACTMASS 178.0953 |
| − | AVERAGEMASS 178.1864 | + | AVERAGEMASS 178.1864 |
| − | SMILES N[C@H]([C@@H](O)1)[C@H](O)[C@@H](O)[C@H](O)[C@@H](N)1 | + | SMILES N[C@H]([C@@H](O)1)[C@H](O)[C@@H](O)[C@H](O)[C@@H](N)1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01854 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01854 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
12 12 0 0 1 0 0 0 0 0999 V2000
3.7321 1.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.8660 0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.8660 -0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.7321 -1.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.5981 -0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.5981 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.7321 2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5 6 1 0 0 0 0
6 1 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 11 1 6 0 0 0
1 7 1 6 0 0 0
2 8 1 1 0 0 0
3 9 1 6 0 0 0
4 10 1 1 0 0 0
6 12 1 1 0 0 0
S SKP 7
ID BMSUM6N0--08
NAME Streptamine
FORMULA C6H14N2O4
EXACTMASS 178.0953
AVERAGEMASS 178.1864
SMILES N[C@H]([C@@H](O)1)[C@H](O)[C@@H](O)[C@H](O)[C@@H](N)1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01854
M END
