Mol:FL6FAAGS0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 28 31 0 0 0 0 0 0 0 0999 V2000 | + | 28 31 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.5981 0.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5981 0.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5981 -0.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5981 -0.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8836 -0.6851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8836 -0.6851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1692 -0.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1692 -0.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1692 0.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1692 0.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8836 0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8836 0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5453 -0.6851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5453 -0.6851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2597 -0.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2597 -0.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2597 0.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2597 0.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5453 0.9649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5453 0.9649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9742 0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9742 0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6946 0.5489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6946 0.5489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4150 0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4150 0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4150 1.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4150 1.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6946 2.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6946 2.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9742 1.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9742 1.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1344 2.2120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1344 2.2120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3124 0.9649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3124 0.9649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5507 -1.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5507 -1.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0387 -2.1188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0387 -2.1188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3015 -1.8321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3015 -1.8321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5902 -1.8245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5902 -1.8245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1072 -1.3074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1072 -1.3074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7521 -1.6478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7521 -1.6478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1344 -1.7505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1344 -1.7505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6293 -2.1590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6293 -2.1590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5891 -2.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5891 -2.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8868 -1.4958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8868 -1.4958 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 |
| − | 19 20 1 1 0 0 0 | + | 19 20 1 1 0 0 0 |
| − | 20 21 1 1 0 0 0 | + | 20 21 1 1 0 0 0 |
| − | 22 21 1 1 0 0 0 | + | 22 21 1 1 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 19 1 0 0 0 0 | + | 24 19 1 0 0 0 0 |
| − | 19 25 1 0 0 0 0 | + | 19 25 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 |
| − | 28 3 1 0 0 0 0 | + | 28 3 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL6FAAGS0001 | + | ID FL6FAAGS0001 |
| − | FORMULA C20H22O8 | + | FORMULA C20H22O8 |
| − | EXACTMASS 390.13146768 | + | EXACTMASS 390.13146768 |
| − | AVERAGEMASS 390.38388000000003 | + | AVERAGEMASS 390.38388000000003 |
| − | SMILES C(O1)(Oc(c4)c(c(cc(O)4)3)CCC(O3)c(c2)ccc(O)c2)C(O)C(C(O)C1)O | + | SMILES C(O1)(Oc(c4)c(c(cc(O)4)3)CCC(O3)c(c2)ccc(O)c2)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/
28 31 0 0 0 0 0 0 0 0999 V2000
-1.5981 0.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5981 -0.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8836 -0.6851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1692 -0.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1692 0.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8836 0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5453 -0.6851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2597 -0.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2597 0.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5453 0.9649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9742 0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6946 0.5489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4150 0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4150 1.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6946 2.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9742 1.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1344 2.2120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3124 0.9649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5507 -1.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0387 -2.1188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3015 -1.8321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5902 -1.8245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1072 -1.3074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7521 -1.6478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1344 -1.7505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6293 -2.1590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5891 -2.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8868 -1.4958 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
19 20 1 1 0 0 0
20 21 1 1 0 0 0
22 21 1 1 0 0 0
22 23 1 0 0 0 0
23 24 1 0 0 0 0
24 19 1 0 0 0 0
19 25 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
28 3 1 0 0 0 0
S SKP 5
ID FL6FAAGS0001
FORMULA C20H22O8
EXACTMASS 390.13146768
AVERAGEMASS 390.38388000000003
SMILES C(O1)(Oc(c4)c(c(cc(O)4)3)CCC(O3)c(c2)ccc(O)c2)C(O)C(C(O)C1)O
M END
