Mol:BMMCBZ1Sp051
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 9 10 0 0 1 0 0 0 0 0999 V2000 | + | 9 10 0 0 1 0 0 0 0 0999 V2000 |
| − | 3.7321 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 0.5670 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 4.5981 0.5670 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 5.5981 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.5981 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.0981 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0981 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 1 2 0 0 0 0 | + | 2 1 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
| − | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 7 9 1 4 0 0 0 | + | 7 9 1 4 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMMCBZ1Sp051 | + | ID BMMCBZ1Sp051 |
| − | NAME Styrene oxide | + | NAME Styrene oxide |
| − | FORMULA C8H8O | + | FORMULA C8H8O |
| − | EXACTMASS 120.0575 | + | EXACTMASS 120.0575 |
| − | AVERAGEMASS 120.1485 | + | AVERAGEMASS 120.1485 |
| − | SMILES c(c2)ccc(c2)C(C1)O1 | + | SMILES c(c2)ccc(c2)C(C1)O1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02083 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02083 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
9 10 0 0 1 0 0 0 0 0999 V2000
3.7321 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.5670 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
5.5981 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0981 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 1 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
1 7 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 4 0 0 0
8 9 1 0 0 0 0
S SKP 7
ID BMMCBZ1Sp051
NAME Styrene oxide
FORMULA C8H8O
EXACTMASS 120.0575
AVERAGEMASS 120.1485
SMILES c(c2)ccc(c2)C(C1)O1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02083
M END
