Mol:BMMCACCHq018
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 8 8 0 0 1 0 0 0 0 0999 V2000 | + | 8 8 0 0 1 0 0 0 0 0999 V2000 |
| − | 3.7321 -0.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 0.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 0 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 |
| − | 2 7 1 4 0 0 0 | + | 2 7 1 4 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 1 8 1 4 0 0 0 | + | 1 8 1 4 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMMCACCHq018 | + | ID BMMCACCHq018 |
| − | NAME Cyclohexane-1,2-diol | + | NAME Cyclohexane-1,2-diol |
| − | FORMULA C6H12O2 | + | FORMULA C6H12O2 |
| − | EXACTMASS 116.0837 | + | EXACTMASS 116.0837 |
| − | AVERAGEMASS 116.1582 | + | AVERAGEMASS 116.1582 |
| − | SMILES OC(C1)C(O)CCC1 | + | SMILES OC(C1)C(O)CCC1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03739 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03739 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
8 8 0 0 1 0 0 0 0 0999 V2000
3.7321 -0.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.7321 0.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
6 1 1 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
2 7 1 4 0 0 0
3 4 1 0 0 0 0
1 8 1 4 0 0 0
S SKP 7
ID BMMCACCHq018
NAME Cyclohexane-1,2-diol
FORMULA C6H12O2
EXACTMASS 116.0837
AVERAGEMASS 116.1582
SMILES OC(C1)C(O)CCC1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03739
M END
