Mol:BMFYB4CAb017
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 10 9 0 0 0 0 0 0 0 0999 V2000 | + | 10 9 0 0 0 0 0 0 0 0999 V2000 |
| − | 2.8660 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -0.6830 0.0000 C 0 3 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.6830 0.0000 C 0 3 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 |
| − | 4.5981 1.3170 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.3170 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0981 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0981 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.0981 0.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0981 0.4510 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 |
| − | 2.0000 -2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6 5 1 0 0 0 0 | + | 6 5 1 0 0 0 0 |
| − | 5 7 1 0 0 0 0 | + | 5 7 1 0 0 0 0 |
| − | 5 8 1 0 0 0 0 | + | 5 8 1 0 0 0 0 |
| − | 5 4 1 0 0 0 0 | + | 5 4 1 0 0 0 0 |
| − | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
| − | 3 2 2 0 0 0 0 | + | 3 2 2 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 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 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMFYB4CAb017 | + | ID BMFYB4CAb017 |
| − | NAME Crotono-betaine | + | NAME Crotono-betaine |
| − | FORMULA C7H13NO2 | + | FORMULA C7H13NO2 |
| − | EXACTMASS 143.0946 | + | EXACTMASS 143.0946 |
| − | AVERAGEMASS 143.1836 | + | AVERAGEMASS 143.1836 |
| − | SMILES OC(=O)[C+1]=CC[N+1](C)(C)C | + | SMILES OC(=O)[C+1]=CC[N+1](C)(C)C |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C11458 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C11458 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
10 9 0 0 0 0 0 0 0 0999 V2000
2.8660 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6830 0.0000 C 0 3 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
4.5981 1.3170 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
5.4641 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0981 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0981 0.4510 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
2.0000 -2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6 5 1 0 0 0 0
5 7 1 0 0 0 0
5 8 1 0 0 0 0
5 4 1 0 0 0 0
4 3 1 0 0 0 0
3 2 2 0 0 0 0
2 1 1 0 0 0 0
1 9 1 0 0 0 0
1 10 2 0 0 0 0
S SKP 7
ID BMFYB4CAb017
NAME Crotono-betaine
FORMULA C7H13NO2
EXACTMASS 143.0946
AVERAGEMASS 143.1836
SMILES OC(=O)[C+1]=CC[N+1](C)(C)C
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C11458
M END
