Mol:BMFYB4CAb009
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 11 10 0 0 0 0 0 0 0 0999 V2000 | + | 11 10 0 0 0 0 0 0 0 0999 V2000 |
| − | 4.5981 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -1.3170 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.3170 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3660 -0.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3660 -0.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -1.8170 0.0000 C 0 3 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -1.8170 0.0000 C 0 3 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3660 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3660 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 0.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 0.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3 2 1 0 0 0 0 | + | 3 2 1 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 1 9 1 0 0 0 0 | + | 1 9 1 0 0 0 0 |
| − | 1 10 2 0 0 0 0 | + | 1 10 2 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 5 8 1 0 0 0 0 | + | 5 8 1 0 0 0 0 |
| − | 5 7 1 0 0 0 0 | + | 5 7 1 0 0 0 0 |
| − | 3 11 2 0 0 0 0 | + | 3 11 2 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMFYB4CAb009 | + | ID BMFYB4CAb009 |
| − | NAME 3-Dehydro-carnitine | + | NAME 3-Dehydro-carnitine |
| − | FORMULA C7H13NO3 | + | FORMULA C7H13NO3 |
| − | EXACTMASS 159.0895 | + | EXACTMASS 159.0895 |
| − | AVERAGEMASS 159.183 | + | AVERAGEMASS 159.183 |
| − | SMILES OC(=O)CC(=O)C[N+1](C)([CH2+1])C | + | SMILES OC(=O)CC(=O)C[N+1](C)([CH2+1])C |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02636 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02636 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
11 10 0 0 0 0 0 0 0 0999 V2000
4.5981 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.3170 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
2.3660 -0.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.8170 0.0000 C 0 3 0 0 0 0 0 0 0 0 0 0
3.3660 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 2 1 0 0 0 0
3 4 1 0 0 0 0
1 9 1 0 0 0 0
1 10 2 0 0 0 0
2 1 1 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
5 8 1 0 0 0 0
5 7 1 0 0 0 0
3 11 2 0 0 0 0
S SKP 7
ID BMFYB4CAb009
NAME 3-Dehydro-carnitine
FORMULA C7H13NO3
EXACTMASS 159.0895
AVERAGEMASS 159.183
SMILES OC(=O)CC(=O)C[N+1](C)([CH2+1])C
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02636
M END
