Mol:BMCCBR--p002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 11 12 0 0 1 0 0 0 0 0999 V2000 | + | 11 12 0 0 1 0 0 0 0 0999 V2000 |
| − | 3.5000 0.8364 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 3.5000 0.8364 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 3.1910 -0.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1910 -0.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0000 -0.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0000 -0.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.8090 -0.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8090 -0.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5000 0.8364 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.5000 0.8364 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 4.0000 1.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0000 1.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5000 0.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5000 0.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -0.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -0.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 1.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 1.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0000 -1.7024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0000 -1.7024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.7601 -0.4237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.7601 -0.4237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 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 6 1 6 0 0 0 | + | 1 6 1 6 0 0 0 |
| − | 5 6 1 6 0 0 0 | + | 5 6 1 6 0 0 0 |
| − | 5 4 1 0 0 0 0 | + | 5 4 1 0 0 0 0 |
| − | 1 5 1 0 0 0 0 | + | 1 5 1 0 0 0 0 |
| − | 4 11 2 0 0 0 0 | + | 4 11 2 0 0 0 0 |
| − | 1 7 1 1 0 0 0 | + | 1 7 1 1 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 7 9 1 0 0 0 0 | + | 7 9 1 0 0 0 0 |
| − | 3 10 2 0 0 0 0 | + | 3 10 2 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMCCBR--p002 | + | ID BMCCBR--p002 |
| − | NAME (+)-Sabinone | + | NAME (+)-Sabinone |
| − | FORMULA C10H14O | + | FORMULA C10H14O |
| − | EXACTMASS 150.1044 | + | EXACTMASS 150.1044 |
| − | AVERAGEMASS 150.2175 | + | AVERAGEMASS 150.2175 |
| − | SMILES CC(C)[C@](C2)(C1)[C@@H](C(=C)C(=O)2)1 | + | SMILES CC(C)[C@](C2)(C1)[C@@H](C(=C)C(=O)2)1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01868 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01868 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
11 12 0 0 1 0 0 0 0 0999 V2000
3.5000 0.8364 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.1910 -0.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 -0.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8090 -0.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5000 0.8364 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.0000 1.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 0.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.7024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 -1.7024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7601 -0.4237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3 4 1 0 0 0 0
3 2 1 0 0 0 0
2 1 1 0 0 0 0
1 6 1 6 0 0 0
5 6 1 6 0 0 0
5 4 1 0 0 0 0
1 5 1 0 0 0 0
4 11 2 0 0 0 0
1 7 1 1 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
3 10 2 0 0 0 0
S SKP 7
ID BMCCBR--p002
NAME (+)-Sabinone
FORMULA C10H14O
EXACTMASS 150.1044
AVERAGEMASS 150.2175
SMILES CC(C)[C@](C2)(C1)[C@@H](C(=C)C(=O)2)1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01868
M END
