Mol:BMCCBR--q001
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 2 0 0 0 0 0 0 0 0 0 | + | 4.0000 -0.7024 0.0000 C 0 0 2 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 |
| − | 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 |
| − | 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 |
| − | 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 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 3 11 1 6 0 0 0 | + | 3 11 1 6 0 0 0 |
| − | 4 10 2 0 0 0 0 | + | 4 10 2 0 0 0 0 |
| − | 1 5 1 0 0 0 0 | + | 1 5 1 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 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMCCBR--q001 | + | ID BMCCBR--q001 |
| − | NAME (+)-cis-Sabinol | + | NAME (+)-cis-Sabinol |
| − | FORMULA C10H16O | + | FORMULA C10H16O |
| − | EXACTMASS 152.1201 | + | EXACTMASS 152.1201 |
| − | AVERAGEMASS 152.2334 | + | AVERAGEMASS 152.2334 |
| − | SMILES CC(C)[C@](C2)(C1)[C@@H](C(=C)[C@H](O)2)1 | + | SMILES CC(C)[C@](C2)(C1)[C@@H](C(=C)[C@H](O)2)1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02213 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02213 |
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 2 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
5.7601 -0.4237 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
1 6 1 6 0 0 0
5 6 1 6 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
3 11 1 6 0 0 0
4 10 2 0 0 0 0
1 5 1 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
S SKP 7
ID BMCCBR--q001
NAME (+)-cis-Sabinol
FORMULA C10H16O
EXACTMASS 152.1201
AVERAGEMASS 152.2334
SMILES CC(C)[C@](C2)(C1)[C@@H](C(=C)[C@H](O)2)1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02213
M END
