Mol:BMCCID--i031
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 16 17 0 0 0 0 0 0 0 0999 V2000 | + | 16 17 0 0 0 0 0 0 0 0999 V2000 |
| − | 5.2435 2.3480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.2435 2.3480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6557 1.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6557 1.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.2435 0.7300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.2435 0.7300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.0605 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.0605 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.9266 1.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.9266 1.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.9266 2.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.9266 2.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.0605 2.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.0605 2.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.1945 2.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.1945 2.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.1945 1.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.1945 1.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.9344 -0.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.9344 -0.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9563 -0.4290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9563 -0.4290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6473 -1.3800 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6473 -1.3800 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6691 -1.5879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6691 -1.5879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -0.8448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -0.8448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3601 -2.5390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3601 -2.5390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.7926 0.5390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.7926 0.5390 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 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 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 |
| − | 5 16 1 0 0 0 0 | + | 5 16 1 0 0 0 0 |
| − | 3 10 1 0 0 0 0 | + | 3 10 1 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 15 2 0 0 0 0 | + | 13 15 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMCCID--i031 | + | ID BMCCID--i031 |
| − | NAME N-Acetyl-serotonin | + | NAME N-Acetyl-serotonin |
| − | FORMULA C12H14N2O2 | + | FORMULA C12H14N2O2 |
| − | EXACTMASS 218.1055 | + | EXACTMASS 218.1055 |
| − | AVERAGEMASS 218.2518 | + | AVERAGEMASS 218.2518 |
| − | SMILES CC(=O)NCCc(c1)c(c2)c(ccc(O)2)n1 | + | SMILES CC(=O)NCCc(c1)c(c2)c(ccc(O)2)n1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00978 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00978 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
16 17 0 0 0 0 0 0 0 0999 V2000
5.2435 2.3480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6557 1.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2435 0.7300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0605 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9266 1.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9266 2.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0605 2.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1945 2.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1945 1.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9344 -0.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9563 -0.4290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6473 -1.3800 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6691 -1.5879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.8448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3601 -2.5390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.7926 0.5390 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 2 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
5 16 1 0 0 0 0
3 10 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
13 15 2 0 0 0 0
13 14 1 0 0 0 0
S SKP 7
ID BMCCID--i031
NAME N-Acetyl-serotonin
FORMULA C12H14N2O2
EXACTMASS 218.1055
AVERAGEMASS 218.2518
SMILES CC(=O)NCCc(c1)c(c2)c(ccc(O)2)n1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00978
M END
