Mol:FL1DHXCS0003
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 30 32 0 0 0 0 0 0 0 0999 V2000 | + | 30 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.5005 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5005 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5005 -1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5005 -1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7861 -1.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7861 -1.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 -1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7861 -0.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7861 -0.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -1.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -1.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 -0.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 -0.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7861 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7861 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5005 -0.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5005 -0.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5005 0.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5005 0.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7861 0.9439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7861 0.9439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 0.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 0.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -2.7685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -2.7685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -0.2936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -0.2936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2150 0.9439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2150 0.9439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2150 -0.2936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2150 -0.2936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0816 -1.9493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0816 -1.9493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7861 1.7039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7861 1.7039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7453 2.2529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7453 2.2529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3666 1.7098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3666 1.7098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0069 0.9671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0069 0.9671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0760 0.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0760 0.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4545 0.6878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4545 0.6878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8142 1.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8142 1.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3396 0.3909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3396 0.3909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3273 2.2963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3273 2.2963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2609 2.7685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2609 2.7685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 0 | + | 1 2 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 |
| − | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 10 1 0 0 0 0 | + | 15 10 1 0 0 0 0 |
| − | 7 16 2 0 0 0 0 | + | 7 16 2 0 0 0 0 |
| − | 5 17 1 0 0 0 0 | + | 5 17 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
| − | 13 18 1 0 0 0 0 | + | 13 18 1 0 0 0 0 |
| − | 8 20 1 0 0 0 0 | + | 8 20 1 0 0 0 0 |
| − | 14 21 1 0 0 0 0 | + | 14 21 1 0 0 0 0 |
| − | 22 23 1 1 0 0 0 | + | 22 23 1 1 0 0 0 |
| − | 23 24 1 1 0 0 0 | + | 23 24 1 1 0 0 0 |
| − | 25 24 1 1 0 0 0 | + | 25 24 1 1 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 22 1 0 0 0 0 | + | 27 22 1 0 0 0 0 |
| − | 24 28 1 0 0 0 0 | + | 24 28 1 0 0 0 0 |
| − | 23 29 1 0 0 0 0 | + | 23 29 1 0 0 0 0 |
| − | 22 30 1 0 0 0 0 | + | 22 30 1 0 0 0 0 |
| − | 6 25 1 0 0 0 0 | + | 6 25 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL1DHXCS0003 | + | ID FL1DHXCS0003 |
| − | FORMULA C20H22O10 | + | FORMULA C20H22O10 |
| − | EXACTMASS 422.121296924 | + | EXACTMASS 422.121296924 |
| − | AVERAGEMASS 422.38268000000005 | + | AVERAGEMASS 422.38268000000005 |
| − | SMILES c(c1O)c(CC(O)C(c(c2)c(O)c(C(C(O)3)OCC(O)C3O)c(c2)O)=O)ccc1O | + | SMILES c(c1O)c(CC(O)C(c(c2)c(O)c(C(C(O)3)OCC(O)C3O)c(c2)O)=O)ccc1O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
30 32 0 0 0 0 0 0 0 0999 V2000
-2.5005 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5005 -1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 -1.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 -0.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -1.9436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 -0.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7861 -0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5005 -0.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5005 0.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7861 0.9439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.5314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -2.7685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -0.2936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2150 0.9439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2150 -0.2936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0816 -1.9493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7861 1.7039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7453 2.2529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3666 1.7098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0069 0.9671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0760 0.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4545 0.6878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8142 1.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3396 0.3909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3273 2.2963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2609 2.7685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 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
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 11 2 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 10 1 0 0 0 0
7 16 2 0 0 0 0
5 17 1 0 0 0 0
1 19 1 0 0 0 0
13 18 1 0 0 0 0
8 20 1 0 0 0 0
14 21 1 0 0 0 0
22 23 1 1 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 22 1 0 0 0 0
24 28 1 0 0 0 0
23 29 1 0 0 0 0
22 30 1 0 0 0 0
6 25 1 0 0 0 0
S SKP 5
ID FL1DHXCS0003
FORMULA C20H22O10
EXACTMASS 422.121296924
AVERAGEMASS 422.38268000000005
SMILES c(c1O)c(CC(O)C(c(c2)c(O)c(C(C(O)3)OCC(O)C3O)c(c2)O)=O)ccc1O
M END
