Mol:BMSUPnA0XX01
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 19 20 0 0 1 0 0 0 0 0999 V2000 | + | 19 20 0 0 1 0 0 0 0 0999 V2000 |
| − | 3.7321 -0.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -1.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -2.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 3.7321 -2.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 2.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 6.3301 2.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 1.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 6.3301 1.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 1.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 5.4641 1.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 1.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 10 19 1 0 0 0 0 | + | 10 19 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 9 8 1 0 0 0 0 | + | 9 8 1 0 0 0 0 |
| − | 8 7 1 0 0 0 0 | + | 8 7 1 0 0 0 0 |
| − | 7 6 1 0 0 0 0 | + | 7 6 1 0 0 0 0 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 9 18 1 6 0 0 0 | + | 9 18 1 6 0 0 0 |
| − | 8 17 1 1 0 0 0 | + | 8 17 1 1 0 0 0 |
| − | 6 15 1 4 0 0 0 | + | 6 15 1 4 0 0 0 |
| − | 7 16 1 6 0 0 0 | + | 7 16 1 6 0 0 0 |
| − | 1 18 1 4 0 0 0 | + | 1 18 1 4 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 |
| − | 5 14 1 0 0 0 0 | + | 5 14 1 0 0 0 0 |
| − | 1 14 1 0 0 0 0 | + | 1 14 1 0 0 0 0 |
| − | 2 11 1 1 0 0 0 | + | 2 11 1 1 0 0 0 |
| − | 3 12 1 6 0 0 0 | + | 3 12 1 6 0 0 0 |
| − | 4 13 1 1 0 0 0 | + | 4 13 1 1 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMSUPnA0XX01 | + | ID BMSUPnA0XX01 |
| − | NAME 1,4-D-Xylan | + | NAME 1,4-D-Xylan |
| − | FORMULA C10H18O9 | + | FORMULA C10H18O9 |
| − | EXACTMASS 282.095 | + | EXACTMASS 282.095 |
| − | AVERAGEMASS 282.2445 | + | AVERAGEMASS 282.2445 |
| − | SMILES O[C@H](C2)[C@H](O)[C@@H](O)C(O2)O[C@H](C1)[C@H](O)[C@@H](O)C(O)O1 | + | SMILES O[C@H](C2)[C@H](O)[C@@H](O)C(O2)O[C@H](C1)[C@H](O)[C@@H](O)C(O)O1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02352 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02352 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
19 20 0 0 1 0 0 0 0 0999 V2000
3.7321 -0.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
2.8660 -0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.8660 -1.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.7321 -2.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.3301 1.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.4641 1.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.5981 1.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10 19 1 0 0 0 0
9 10 1 0 0 0 0
9 8 1 0 0 0 0
8 7 1 0 0 0 0
7 6 1 0 0 0 0
6 19 1 0 0 0 0
9 18 1 6 0 0 0
8 17 1 1 0 0 0
6 15 1 4 0 0 0
7 16 1 6 0 0 0
1 18 1 4 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
5 14 1 0 0 0 0
1 14 1 0 0 0 0
2 11 1 1 0 0 0
3 12 1 6 0 0 0
4 13 1 1 0 0 0
S SKP 7
ID BMSUPnA0XX01
NAME 1,4-D-Xylan
FORMULA C10H18O9
EXACTMASS 282.095
AVERAGEMASS 282.2445
SMILES O[C@H](C2)[C@H](O)[C@@H](O)C(O2)O[C@H](C1)[C@H](O)[C@@H](O)C(O)O1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02352
M END
