Mol:FL6FACGS0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 29 32 0 0 0 0 0 0 0 0999 V2000 | + | 29 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.6806 0.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6806 0.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6806 -0.5744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6806 -0.5744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9661 -0.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9661 -0.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2517 -0.5744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2517 -0.5744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2517 0.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2517 0.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9661 0.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9661 0.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4628 -0.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4628 -0.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1772 -0.5744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1772 -0.5744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1772 0.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1772 0.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4628 0.6630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4628 0.6630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8917 0.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8917 0.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6121 0.2470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6121 0.2470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3325 0.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3325 0.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3325 1.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3325 1.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6121 1.9107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6121 1.9107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8917 1.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8917 1.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0519 1.9101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0519 1.9101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3949 0.6630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3949 0.6630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6121 2.7414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6121 2.7414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5301 -1.9305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5301 -1.9305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0181 -2.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0181 -2.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2809 -2.3196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2809 -2.3196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5696 -2.3120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5696 -2.3120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0866 -1.7949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0866 -1.7949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7315 -2.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7315 -2.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0519 -2.2380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0519 -2.2380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5674 -2.6466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5674 -2.6466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6509 -2.7414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6509 -2.7414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9693 -1.7977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9693 -1.7977 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 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 9 11 1 6 0 0 0 | + | 9 11 1 6 0 0 0 |
| − | 11 12 2 0 0 0 0 | + | 11 12 2 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 2 0 0 0 0 | + | 13 14 2 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
| − | 16 11 1 0 0 0 0 | + | 16 11 1 0 0 0 0 |
| − | 14 17 1 0 0 0 0 | + | 14 17 1 0 0 0 0 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 15 19 1 0 0 0 0 | + | 15 19 1 0 0 0 0 |
| − | 20 21 1 1 0 0 0 | + | 20 21 1 1 0 0 0 |
| − | 21 22 1 1 0 0 0 | + | 21 22 1 1 0 0 0 |
| − | 23 22 1 1 0 0 0 | + | 23 22 1 1 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 20 1 0 0 0 0 | + | 25 20 1 0 0 0 0 |
| − | 20 26 1 0 0 0 0 | + | 20 26 1 0 0 0 0 |
| − | 21 27 1 0 0 0 0 | + | 21 27 1 0 0 0 0 |
| − | 22 28 1 0 0 0 0 | + | 22 28 1 0 0 0 0 |
| − | 23 29 1 0 0 0 0 | + | 23 29 1 0 0 0 0 |
| − | 29 3 1 0 0 0 0 | + | 29 3 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL6FACGS0001 | + | ID FL6FACGS0001 |
| − | FORMULA C20H22O9 | + | FORMULA C20H22O9 |
| − | EXACTMASS 406.126382302 | + | EXACTMASS 406.126382302 |
| − | AVERAGEMASS 406.38328 | + | AVERAGEMASS 406.38328 |
| − | SMILES C(O1)(Oc(c4)c(c(cc(O)4)3)CCC(O3)c(c2)cc(c(O)c2)O)C(O)C(C(O)C1)O | + | SMILES C(O1)(Oc(c4)c(c(cc(O)4)3)CCC(O3)c(c2)cc(c(O)c2)O)C(O)C(C(O)C1)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
29 32 0 0 0 0 0 0 0 0999 V2000
-1.6806 0.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6806 -0.5744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9661 -0.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2517 -0.5744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2517 0.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9661 0.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4628 -0.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1772 -0.5744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1772 0.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4628 0.6630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8917 0.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6121 0.2470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3325 0.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3325 1.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6121 1.9107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8917 1.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0519 1.9101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3949 0.6630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6121 2.7414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5301 -1.9305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0181 -2.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2809 -2.3196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5696 -2.3120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0866 -1.7949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7315 -2.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0519 -2.2380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5674 -2.6466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6509 -2.7414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9693 -1.7977 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 5 1 0 0 0 0
9 11 1 6 0 0 0
11 12 2 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 11 1 0 0 0 0
14 17 1 0 0 0 0
1 18 1 0 0 0 0
15 19 1 0 0 0 0
20 21 1 1 0 0 0
21 22 1 1 0 0 0
23 22 1 1 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 20 1 0 0 0 0
20 26 1 0 0 0 0
21 27 1 0 0 0 0
22 28 1 0 0 0 0
23 29 1 0 0 0 0
29 3 1 0 0 0 0
S SKP 5
ID FL6FACGS0001
FORMULA C20H22O9
EXACTMASS 406.126382302
AVERAGEMASS 406.38328
SMILES C(O1)(Oc(c4)c(c(cc(O)4)3)CCC(O3)c(c2)cc(c(O)c2)O)C(O)C(C(O)C1)O
M END
