Mol:KOX00637
From Metabolomics.JP
(Difference between revisions)
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| − | + | ||
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| − | 10 11 0 1 0 999 V2000 | + | 10 11 0 1 0 999 V2000 |
| − | -0.6348 1.2375 0.0000 C 0 0 1 0 0 0 0 0 0 | + | -0.6348 1.2375 0.0000 C 0 0 1 0 0 0 0 0 0 |
| − | -1.3492 0.8250 0.0000 C 0 0 1 0 0 0 0 0 0 | + | -1.3492 0.8250 0.0000 C 0 0 1 0 0 0 0 0 0 |
| − | -1.3492 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 | + | -1.3492 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 |
| − | -0.6348 -0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 | + | -0.6348 -0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 |
| − | 0.0797 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 | + | 0.0797 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 |
| − | 0.0797 0.8250 0.0000 C 0 0 1 0 0 0 0 0 0 | + | 0.0797 0.8250 0.0000 C 0 0 1 0 0 0 0 0 0 |
| − | 0.8643 -0.2549 0.0000 C 0 0 1 0 0 0 0 0 0 | + | 0.8643 -0.2549 0.0000 C 0 0 1 0 0 0 0 0 0 |
| − | 1.3492 0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 | + | 1.3492 0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 |
| − | 0.8643 1.0799 0.0000 N 0 0 1 0 0 0 0 0 0 | + | 0.8643 1.0799 0.0000 N 0 0 1 0 0 0 0 0 0 |
| − | -0.6348 -1.2375 0.0000 N 0 0 1 0 0 0 0 0 0 | + | -0.6348 -1.2375 0.0000 N 0 0 1 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 | + | 1 2 2 0 0 0 |
| − | 2 3 1 0 0 0 | + | 2 3 1 0 0 0 |
| − | 3 4 2 0 0 0 | + | 3 4 2 0 0 0 |
| − | 4 5 1 0 0 0 | + | 4 5 1 0 0 0 |
| − | 5 6 2 0 0 0 | + | 5 6 2 0 0 0 |
| − | 6 1 1 0 0 0 | + | 6 1 1 0 0 0 |
| − | 5 7 1 0 0 0 | + | 5 7 1 0 0 0 |
| − | 7 8 2 0 0 0 | + | 7 8 2 0 0 0 |
| − | 8 9 1 0 0 0 | + | 8 9 1 0 0 0 |
| − | 9 6 1 0 0 0 | + | 9 6 1 0 0 0 |
| − | 4 10 1 0 0 0 | + | 4 10 1 0 0 0 |
| − | S SKP | + | S SKP 8 |
| − | CAS_RN 5192-23-4 | + | CAS_RN 5192-23-4 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+null | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+null |
| − | NAME null | + | NAME null |
| + | ID KOX00637 | ||
| + | FORMULA C8H8N2 | ||
| + | EXACTMASS 132.068748266 | ||
| + | AVERAGEMASS 132.1626 | ||
| + | SMILES N[c@@]([c@H]2)[c@]([c@@H]1)[c@]([c@H][c@@H]2)n[c@H]1 | ||
M END | M END | ||
Revision as of 14:26, 11 June 2009
10 11 0 1 0 999 V2000
-0.6348 1.2375 0.0000 C 0 0 1 0 0 0 0 0 0
-1.3492 0.8250 0.0000 C 0 0 1 0 0 0 0 0 0
-1.3492 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0
-0.6348 -0.4125 0.0000 C 0 0 1 0 0 0 0 0 0
0.0797 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0
0.0797 0.8250 0.0000 C 0 0 1 0 0 0 0 0 0
0.8643 -0.2549 0.0000 C 0 0 1 0 0 0 0 0 0
1.3492 0.4125 0.0000 C 0 0 1 0 0 0 0 0 0
0.8643 1.0799 0.0000 N 0 0 1 0 0 0 0 0 0
-0.6348 -1.2375 0.0000 N 0 0 1 0 0 0 0 0 0
1 2 2 0 0 0
2 3 1 0 0 0
3 4 2 0 0 0
4 5 1 0 0 0
5 6 2 0 0 0
6 1 1 0 0 0
5 7 1 0 0 0
7 8 2 0 0 0
8 9 1 0 0 0
9 6 1 0 0 0
4 10 1 0 0 0
S SKP 8
CAS_RN 5192-23-4
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+null
NAME null
ID KOX00637
FORMULA C8H8N2
EXACTMASS 132.068748266
AVERAGEMASS 132.1626
SMILES N[c@@]([c@H]2)[c@]([c@@H]1)[c@]([c@H][c@@H]2)n[c@H]1
M END
