Mol:BMMCBZ2Pm009
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 0 0 0 0 0 0999 V2000 | + | 12 12 0 0 0 0 0 0 0 0999 V2000 |
− | 2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 6.3301 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 7.1962 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 8.0622 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 7.1962 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 6 2 0 0 0 0 | + | 1 6 2 0 0 0 0 |
− | 6 5 1 0 0 0 0 | + | 6 5 1 0 0 0 0 |
− | 7 4 1 0 0 0 0 | + | 7 4 1 0 0 0 0 |
− | 4 5 2 0 0 0 0 | + | 4 5 2 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 |
− | 11 9 1 0 0 0 0 | + | 11 9 1 0 0 0 0 |
− | 8 7 1 0 0 0 0 | + | 8 7 1 0 0 0 0 |
− | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
− | 1 12 1 0 0 0 0 | + | 1 12 1 0 0 0 0 |
− | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
− | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
− | S SKP 7 | + | S SKP 7 |
− | ID BMMCBZ2Pm009 | + | ID BMMCBZ2Pm009 |
− | NAME 4-[2-(Dimethyl-amino)-ethyl]-phenol | + | NAME 4-[2-(Dimethyl-amino)-ethyl]-phenol |
− | FORMULA C10H15NO | + | FORMULA C10H15NO |
− | EXACTMASS 165.1153 | + | EXACTMASS 165.1153 |
− | AVERAGEMASS 165.2322 | + | AVERAGEMASS 165.2322 |
− | SMILES CN(C)CCc(c1)ccc(O)c1 | + | SMILES CN(C)CCc(c1)ccc(O)c1 |
− | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06199 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06199 |
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 0 0 0 0 0 0999 V2000 2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 6 5 1 0 0 0 0 7 4 1 0 0 0 0 4 5 2 0 0 0 0 4 3 1 0 0 0 0 3 2 2 0 0 0 0 11 9 1 0 0 0 0 8 7 1 0 0 0 0 2 1 1 0 0 0 0 1 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 S SKP 7 ID BMMCBZ2Pm009 NAME 4-[2-(Dimethyl-amino)-ethyl]-phenol FORMULA C10H15NO EXACTMASS 165.1153 AVERAGEMASS 165.2322 SMILES CN(C)CCc(c1)ccc(O)c1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06199 M END