Mol:BMSUM6Nm--01
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 15 15 0 0 1 0 0 0 0 0999 V2000 | + | 15 15 0 0 1 0 0 0 0 0999 V2000 |
− | 4.5981 0.7500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 4.5981 0.7500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
− | 3.7321 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 3.7321 -0.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
− | 4.5981 -1.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.5981 -1.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 5.4641 -0.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.4641 -0.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
− | 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7321 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0000 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.8660 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.5981 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.4641 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 7.1962 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 15 6 1 0 0 0 0 | + | 15 6 1 0 0 0 0 |
− | 5 14 1 6 0 0 0 | + | 5 14 1 6 0 0 0 |
− | 14 1 1 0 0 0 0 | + | 14 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 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
− | 1 7 1 4 0 0 0 | + | 1 7 1 4 0 0 0 |
− | 2 8 1 1 0 0 0 | + | 2 8 1 1 0 0 0 |
− | 3 12 1 6 0 0 0 | + | 3 12 1 6 0 0 0 |
− | 4 13 1 1 0 0 0 | + | 4 13 1 1 0 0 0 |
− | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
− | 9 11 2 0 0 0 0 | + | 9 11 2 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 BMSUM6Nm--01 | + | ID BMSUM6Nm--01 |
− | NAME N-Acetyl-D-glucosaminyl-amine | + | NAME N-Acetyl-D-glucosaminyl-amine |
− | FORMULA C8H16N2O5 | + | FORMULA C8H16N2O5 |
− | EXACTMASS 220.1059 | + | EXACTMASS 220.1059 |
− | AVERAGEMASS 220.2231 | + | AVERAGEMASS 220.2231 |
− | SMILES OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](NC(C)=O)C(N)1 | + | SMILES OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](NC(C)=O)C(N)1 |
− | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01239 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01239 |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 15 15 0 0 1 0 0 0 0 0999 V2000 4.5981 0.7500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7321 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7321 -0.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4641 -0.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15 6 1 0 0 0 0 5 14 1 6 0 0 0 14 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 6 1 0 0 0 0 1 7 1 4 0 0 0 2 8 1 1 0 0 0 3 12 1 6 0 0 0 4 13 1 1 0 0 0 8 9 1 0 0 0 0 9 11 2 0 0 0 0 9 10 1 0 0 0 0 S SKP 7 ID BMSUM6Nm--01 NAME N-Acetyl-D-glucosaminyl-amine FORMULA C8H16N2O5 EXACTMASS 220.1059 AVERAGEMASS 220.2231 SMILES OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](NC(C)=O)C(N)1 KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01239 M END