Mol:FL3FEAGS0004
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 31 34 0 0 0 0 0 0 0 0999 V2000 | + | 31 34 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.1262 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1262 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1262 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1262 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4250 -2.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4250 -2.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2761 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2761 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2761 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2761 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4250 -0.4789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4250 -0.4789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9773 -2.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9773 -2.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6785 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6785 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6785 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6785 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9773 -0.4789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9773 -0.4789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9773 -2.7295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9773 -2.7295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3795 -0.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3795 -0.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0940 -0.8916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0940 -0.8916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8086 -0.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8086 -0.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8086 0.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8086 0.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0940 0.7588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0940 0.7588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3795 0.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3795 0.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8271 -0.4790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8271 -0.4790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5231 0.7586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5231 0.7586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4250 -2.7298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4250 -2.7298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8259 -2.0974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8259 -2.0974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6582 -0.0463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6582 -0.0463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6817 -0.6101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6817 -0.6101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9915 0.4742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9915 0.4742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6817 1.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6817 1.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6582 2.1289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6582 2.1289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3484 1.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3484 1.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2607 2.7298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2607 2.7298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6790 2.3689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6790 2.3689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1224 1.6703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1224 1.6703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5231 -0.0418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5231 -0.0418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 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 2 0 0 0 0 | + | 8 9 2 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 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 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 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 12 1 0 0 0 0 | + | 17 12 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 3 1 0 0 0 0 | + | 20 3 1 0 0 0 0 |
| − | 2 21 1 0 0 0 0 | + | 2 21 1 0 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 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 1 1 0 0 0 | + | 26 27 1 1 0 0 0 |
| − | 27 22 1 1 0 0 0 | + | 27 22 1 1 0 0 0 |
| − | 26 28 1 0 0 0 0 | + | 26 28 1 0 0 0 0 |
| − | 25 29 1 0 0 0 0 | + | 25 29 1 0 0 0 0 |
| − | 27 30 1 0 0 0 0 | + | 27 30 1 0 0 0 0 |
| − | 22 31 1 0 0 0 0 | + | 22 31 1 0 0 0 0 |
| − | 23 18 1 0 0 0 0 | + | 23 18 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL3FEAGS0004 | + | ID FL3FEAGS0004 |
| − | FORMULA C21H20O10 | + | FORMULA C21H20O10 |
| − | EXACTMASS 432.10564686 | + | EXACTMASS 432.10564686 |
| − | AVERAGEMASS 432.37749999999994 | + | AVERAGEMASS 432.37749999999994 |
| − | SMILES C(=O)(C=3)c(c2O)c(OC3c(c4)ccc(O)c4)cc(c2O)OC(O1)C(O)C(O)C(O)C(C)1 | + | SMILES C(=O)(C=3)c(c2O)c(OC3c(c4)ccc(O)c4)cc(c2O)OC(O1)C(O)C(O)C(O)C(C)1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
31 34 0 0 0 0 0 0 0 0999 V2000
-1.1262 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1262 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4250 -2.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2761 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2761 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4250 -0.4789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9773 -2.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6785 -1.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6785 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9773 -0.4789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9773 -2.7295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3795 -0.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0940 -0.8916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8086 -0.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8086 0.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0940 0.7588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3795 0.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8271 -0.4790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5231 0.7586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4250 -2.7298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8259 -2.0974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6582 -0.0463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6817 -0.6101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9915 0.4742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6817 1.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6582 2.1289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3484 1.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2607 2.7298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6790 2.3689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1224 1.6703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5231 -0.0418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 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 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
1 18 1 0 0 0 0
15 19 1 0 0 0 0
20 3 1 0 0 0 0
2 21 1 0 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 26 1 0 0 0 0
26 27 1 1 0 0 0
27 22 1 1 0 0 0
26 28 1 0 0 0 0
25 29 1 0 0 0 0
27 30 1 0 0 0 0
22 31 1 0 0 0 0
23 18 1 0 0 0 0
S SKP 5
ID FL3FEAGS0004
FORMULA C21H20O10
EXACTMASS 432.10564686
AVERAGEMASS 432.37749999999994
SMILES C(=O)(C=3)c(c2O)c(OC3c(c4)ccc(O)c4)cc(c2O)OC(O1)C(O)C(O)C(O)C(C)1
M END
