Mol:BMACIZAMm001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 17 17 0 0 1 0 0 0 0 0999 V2000 | + | 17 17 0 0 1 0 0 0 0 0999 V2000 |
| − | 2.3090 1.6981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3090 1.6981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8090 0.1592 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8090 0.1592 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6180 0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6180 0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3090 1.6981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3090 1.6981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5691 0.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5691 0.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.3122 1.1071 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.3122 1.1071 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 5.1043 2.0853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.1043 2.0853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.2633 0.7981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.2633 0.7981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.4712 -0.1801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.4712 -0.1801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.4223 -0.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.4223 -0.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.6302 -1.4672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.6302 -1.4672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.5812 -1.7762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.5812 -1.7762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.7891 -2.7544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.7891 -2.7544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1533 2.3943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1533 2.3943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.8475 2.7544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.8475 2.7544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.7281 -0.8492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.7281 -0.8492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4 6 1 0 0 0 0 | + | 4 6 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 |
| − | 7 6 1 0 0 0 0 | + | 7 6 1 0 0 0 0 |
| − | 5 1 1 0 0 0 0 | + | 5 1 1 0 0 0 0 |
| − | 3 2 2 0 0 0 0 | + | 3 2 2 0 0 0 0 |
| − | 7 9 1 1 0 0 0 | + | 7 9 1 1 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 8 15 1 0 0 0 0 | + | 8 15 1 0 0 0 0 |
| − | 8 16 2 0 0 0 0 | + | 8 16 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 10 17 2 0 0 0 0 | + | 10 17 2 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 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMACIZAMm001 | + | ID BMACIZAMm001 |
| − | NAME L-Homocarnosine | + | NAME L-Homocarnosine |
| − | FORMULA C10H16N4O3 | + | FORMULA C10H16N4O3 |
| − | EXACTMASS 240.1222 | + | EXACTMASS 240.1222 |
| − | AVERAGEMASS 240.2592 | + | AVERAGEMASS 240.2592 |
| − | SMILES NCCCC(=O)N[C@H](C(O)=O)Cc(c1)ncn1 | + | SMILES NCCCC(=O)N[C@H](C(O)=O)Cc(c1)ncn1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00884 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00884 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
17 17 0 0 1 0 0 0 0 0999 V2000
2.3090 1.6981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8090 0.1592 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.6180 0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3090 1.6981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5691 0.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3122 1.1071 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.1043 2.0853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2633 0.7981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.4712 -0.1801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4223 -0.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6302 -1.4672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5812 -1.7762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7891 -2.7544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.1533 2.3943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8475 2.7544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7281 -0.8492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4 6 1 0 0 0 0
4 5 2 0 0 0 0
4 3 1 0 0 0 0
7 6 1 0 0 0 0
5 1 1 0 0 0 0
3 2 2 0 0 0 0
7 9 1 1 0 0 0
7 8 1 0 0 0 0
9 10 1 0 0 0 0
8 15 1 0 0 0 0
8 16 2 0 0 0 0
10 11 1 0 0 0 0
10 17 2 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
1 2 1 0 0 0 0
S SKP 7
ID BMACIZAMm001
NAME L-Homocarnosine
FORMULA C10H16N4O3
EXACTMASS 240.1222
AVERAGEMASS 240.2592
SMILES NCCCC(=O)N[C@H](C(O)=O)Cc(c1)ncn1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00884
M END
