Mol:BMCCID--e001
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 |
| − | 8.6521 -0.9732 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.6521 -0.9732 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.6576 -1.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.6576 -1.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.2509 -0.1642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.2509 -0.1642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.9940 1.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.9940 1.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.8600 2.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.8600 2.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.7260 1.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.7260 1.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 9.7260 0.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 9.7260 0.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.8600 0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.8600 0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.9940 0.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.9940 0.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.2727 0.0437 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 6.2727 0.0437 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 5.6036 -0.6994 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 5.6036 -0.6994 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 4.6254 -0.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6254 -0.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.9637 0.9948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.9637 0.9948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.9126 -1.6505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.9126 -1.6505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9563 -1.2347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9563 -1.2347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9781 -1.0268 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9781 -1.0268 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1861 -0.0486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1861 -0.0486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7702 -2.0049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7702 -2.0049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -0.8189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -0.8189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5 4 2 0 0 0 0 | + | 5 4 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 7 2 0 0 0 0 | + | 6 7 2 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 9 4 1 0 0 0 0 | + | 9 4 1 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 3 2 2 0 0 0 0 | + | 3 2 2 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 1 8 1 0 0 0 0 | + | 1 8 1 0 0 0 0 |
| − | 9 3 1 0 0 0 0 | + | 9 3 1 0 0 0 0 |
| − | 3 10 1 0 0 0 0 | + | 3 10 1 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 10 13 1 1 0 0 0 | + | 10 13 1 1 0 0 0 |
| − | 11 14 1 6 0 0 0 | + | 11 14 1 6 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 15 1 0 0 0 0 | + | 12 15 1 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | 16 18 1 0 0 0 0 | + | 16 18 1 0 0 0 0 |
| − | 16 19 2 0 0 0 0 | + | 16 19 2 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMCCID--e001 | + | ID BMCCID--e001 |
| − | NAME (3-Indolyl)-glycerol phosphate | + | NAME (3-Indolyl)-glycerol phosphate |
| − | FORMULA C11H14NO6P | + | FORMULA C11H14NO6P |
| − | EXACTMASS 287.0558 | + | EXACTMASS 287.0558 |
| − | AVERAGEMASS 287.2057 | + | AVERAGEMASS 287.2057 |
| − | SMILES O[C@H](COP(O)(O)=O)[C@@H](O)c(c1)c(c2)c(ccc2)n1 | + | SMILES O[C@H](COP(O)(O)=O)[C@@H](O)c(c1)c(c2)c(ccc2)n1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03506 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03506 |
M END | M END | ||
| − | |||
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
8.6521 -0.9732 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.6576 -1.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2509 -0.1642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9940 1.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8600 2.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7260 1.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7260 0.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8600 0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9940 0.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2727 0.0437 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.6036 -0.6994 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.6254 -0.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9637 0.9948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9126 -1.6505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9563 -1.2347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9781 -1.0268 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
3.1861 -0.0486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7702 -2.0049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.8189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5 4 2 0 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
7 8 1 0 0 0 0
9 4 1 0 0 0 0
8 9 2 0 0 0 0
3 2 2 0 0 0 0
2 1 1 0 0 0 0
1 8 1 0 0 0 0
9 3 1 0 0 0 0
3 10 1 0 0 0 0
10 11 1 0 0 0 0
10 13 1 1 0 0 0
11 14 1 6 0 0 0
11 12 1 0 0 0 0
12 15 1 0 0 0 0
15 16 1 0 0 0 0
16 17 1 0 0 0 0
16 18 1 0 0 0 0
16 19 2 0 0 0 0
S SKP 7
ID BMCCID--e001
NAME (3-Indolyl)-glycerol phosphate
FORMULA C11H14NO6P
EXACTMASS 287.0558
AVERAGEMASS 287.2057
SMILES O[C@H](COP(O)(O)=O)[C@@H](O)c(c1)c(c2)c(ccc2)n1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03506
M END
