Mol:BMCCID--i030
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 14 15 0 0 0 0 0 0 0 0999 V2000 | + | 14 15 0 0 0 0 0 0 0 0999 V2000 |
| − | 3.5878 0.4374 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5878 0.4374 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0000 -0.3716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0000 -0.3716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5878 -1.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5878 -1.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4049 -1.3716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4049 -1.3716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.2709 -0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.2709 -0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.2709 0.1284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.2709 0.1284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4049 0.6284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4049 0.6284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5388 0.1284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5388 0.1284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5388 -0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5388 -0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2788 1.3885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2788 1.3885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9479 2.1316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9479 2.1316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3006 1.5964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3006 1.5964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -0.3716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -0.3716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2788 -2.1316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2788 -2.1316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5 4 2 0 0 0 0 | + | 5 4 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 7 2 0 0 0 0 | + | 6 7 2 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 9 4 1 0 0 0 0 | + | 9 4 1 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 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 8 1 0 0 0 0 | + | 1 8 1 0 0 0 0 |
| − | 9 3 1 0 0 0 0 | + | 9 3 1 0 0 0 0 |
| − | 3 14 2 0 0 0 0 | + | 3 14 2 0 0 0 0 |
| − | 1 10 1 0 0 0 0 | + | 1 10 1 0 0 0 0 |
| − | 10 12 2 0 0 0 0 | + | 10 12 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 2 13 2 0 0 0 0 | + | 2 13 2 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMCCID--i030 | + | ID BMCCID--i030 |
| − | NAME N-Acetyl-isatin | + | NAME N-Acetyl-isatin |
| − | FORMULA C10H7NO3 | + | FORMULA C10H7NO3 |
| − | EXACTMASS 189.0425 | + | EXACTMASS 189.0425 |
| − | AVERAGEMASS 189.1675 | + | AVERAGEMASS 189.1675 |
| − | SMILES CC(=O)n(c(=O)1)c(c2)c(ccc2)c(=O)1 | + | SMILES CC(=O)n(c(=O)1)c(c2)c(ccc2)c(=O)1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02172 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02172 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
14 15 0 0 0 0 0 0 0 0999 V2000
3.5878 0.4374 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -0.3716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5878 -1.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4049 -1.3716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2709 -0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2709 0.1284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4049 0.6284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5388 0.1284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5388 -0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2788 1.3885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9479 2.1316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3006 1.5964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.3716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2788 -2.1316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5 4 2 0 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
7 8 1 0 0 0 0
9 4 1 0 0 0 0
8 9 2 0 0 0 0
3 2 1 0 0 0 0
2 1 1 0 0 0 0
1 8 1 0 0 0 0
9 3 1 0 0 0 0
3 14 2 0 0 0 0
1 10 1 0 0 0 0
10 12 2 0 0 0 0
10 11 1 0 0 0 0
2 13 2 0 0 0 0
S SKP 7
ID BMCCID--i030
NAME N-Acetyl-isatin
FORMULA C10H7NO3
EXACTMASS 189.0425
AVERAGEMASS 189.1675
SMILES CC(=O)n(c(=O)1)c(c2)c(ccc2)c(=O)1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02172
M END
