Mol:BMFYB4CAb015
From Metabolomics.JP
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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 |
− | 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 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -1.8170 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 | + | 3.3660 -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 |
− | 4 3 1 0 0 0 0 | + | 4 3 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 10 1 0 0 0 0 | + | 1 10 1 0 0 0 0 |
− | 1 9 2 0 0 0 0 | + | 1 9 2 0 0 0 0 |
− | 4 5 1 0 0 0 0 | + | 4 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 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
− | S SKP 7 | + | S SKP 7 |
− | ID BMFYB4CAb015 | + | ID BMFYB4CAb015 |
− | NAME 4- | + | NAME (4-Hydroxy-4-oxobutyl) -trimethylazanium |
− | FORMULA C7H16NO2 | + | CAS_RN 10329-41-6 |
− | EXACTMASS 146.1181 | + | FORMULA C7H16NO2 |
− | AVERAGEMASS 146.2074 | + | EXACTMASS 146.1181 |
− | SMILES OC(=O)CCC[N+1](C)(C)C | + | AVERAGEMASS 146.2074 |
− | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01181 | + | SMILES OC(=O)CCC[N+1](C)(C)C |
+ | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01181 | ||
M END | M END | ||
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Latest revision as of 16:50, 16 June 2010
Copyright: ARM project http://www.metabolome.jp/ 10 9 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 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 5.4641 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4 3 1 0 0 0 0 3 2 1 0 0 0 0 2 1 1 0 0 0 0 1 10 1 0 0 0 0 1 9 2 0 0 0 0 4 5 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 6 1 0 0 0 0 S SKP 7 ID BMFYB4CAb015 NAME (4-Hydroxy-4-oxobutyl) -trimethylazanium CAS_RN 10329-41-6 FORMULA C7H16NO2 EXACTMASS 146.1181 AVERAGEMASS 146.2074 SMILES OC(=O)CCC[N+1](C)(C)C KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01181 M END