Mol:FL5FAKGS0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 35 38 0 0 0 0 0 0 0 0999 V2000 | + | 35 38 0 0 0 0 0 0 0 0999 V2000 |
| − | 1.4456 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4456 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7311 0.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7311 0.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7311 1.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7311 1.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4456 2.1548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4456 2.1548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1600 1.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1600 1.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1600 0.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1600 0.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0166 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0166 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6979 0.9173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6979 0.9173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4123 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4123 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4123 -0.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4123 -0.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6978 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6978 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0166 -0.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0166 -0.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1268 0.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1268 0.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8413 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8413 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8413 -0.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8413 -0.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1268 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1268 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6978 -1.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6978 -1.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5557 0.9173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5557 0.9173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7922 -0.8123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7922 -0.8123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1268 -1.4237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1268 -1.4237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8745 2.1548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8745 2.1548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4456 2.9797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4456 2.9797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8379 0.5259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8379 0.5259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5557 1.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5557 1.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5023 0.9095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5023 0.9095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3297 -1.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3297 -1.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5432 -2.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5432 -2.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1645 -2.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1645 -2.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9898 -2.2590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9898 -2.2590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2035 -1.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2035 -1.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4957 -1.8861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4957 -1.8861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1529 -2.8675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1529 -2.8675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2490 -2.9797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2490 -2.9797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0617 -2.6878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0617 -2.6878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9408 -2.2435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9408 -2.2435 0.0000 C 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 |
| − | 2 7 1 0 0 0 0 | + | 2 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 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 7 2 0 0 0 0 | + | 12 7 2 0 0 0 0 |
| − | 9 13 1 0 0 0 0 | + | 9 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 10 1 0 0 0 0 | + | 16 10 1 0 0 0 0 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 11 17 2 0 0 0 0 | + | 11 17 2 0 0 0 0 |
| − | 12 19 1 0 0 0 0 | + | 12 19 1 0 0 0 0 |
| − | 16 20 1 0 0 0 0 | + | 16 20 1 0 0 0 0 |
| − | 5 21 1 0 0 0 0 | + | 5 21 1 0 0 0 0 |
| − | 4 22 1 0 0 0 0 | + | 4 22 1 0 0 0 0 |
| − | 6 23 1 0 0 0 0 | + | 6 23 1 0 0 0 0 |
| − | 21 24 1 0 0 0 0 | + | 21 24 1 0 0 0 0 |
| − | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 1 1 0 0 0 | + | 27 28 1 1 0 0 0 |
| − | 29 28 1 1 0 0 0 | + | 29 28 1 1 0 0 0 |
| − | 30 29 1 1 0 0 0 | + | 30 29 1 1 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
| − | 31 26 1 0 0 0 0 | + | 31 26 1 0 0 0 0 |
| − | 29 32 1 0 0 0 0 | + | 29 32 1 0 0 0 0 |
| − | 28 33 1 0 0 0 0 | + | 28 33 1 0 0 0 0 |
| − | 27 34 1 0 0 0 0 | + | 27 34 1 0 0 0 0 |
| − | 26 35 1 0 0 0 0 | + | 26 35 1 0 0 0 0 |
| − | 30 19 1 0 0 0 0 | + | 30 19 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FAKGS0001 | + | ID FL5FAKGS0001 |
| − | FORMULA C23H24O12 | + | FORMULA C23H24O12 |
| − | EXACTMASS 492.126776232 | + | EXACTMASS 492.126776232 |
| − | AVERAGEMASS 492.42946 | + | AVERAGEMASS 492.42946 |
| − | SMILES OC(C1OC(C4=O)=C(Oc(c43)cc(cc3O)O)c(c2)cc(O)c(OC)c2OC)C(C(O)C(C)O1)O | + | SMILES OC(C1OC(C4=O)=C(Oc(c43)cc(cc3O)O)c(c2)cc(O)c(OC)c2OC)C(C(O)C(C)O1)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
35 38 0 0 0 0 0 0 0 0999 V2000
1.4456 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7311 0.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7311 1.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4456 2.1548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1600 1.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1600 0.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0166 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6979 0.9173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4123 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4123 -0.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6978 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0166 -0.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1268 0.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8413 0.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8413 -0.3202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1268 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6978 -1.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5557 0.9173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7922 -0.8123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1268 -1.4237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8745 2.1548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4456 2.9797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8379 0.5259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5557 1.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5023 0.9095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3297 -1.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5432 -2.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1645 -2.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9898 -2.2590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2035 -1.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4957 -1.8861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1529 -2.8675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2490 -2.9797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0617 -2.6878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9408 -2.2435 0.0000 C 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
2 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 7 2 0 0 0 0
9 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 10 1 0 0 0 0
14 18 1 0 0 0 0
11 17 2 0 0 0 0
12 19 1 0 0 0 0
16 20 1 0 0 0 0
5 21 1 0 0 0 0
4 22 1 0 0 0 0
6 23 1 0 0 0 0
21 24 1 0 0 0 0
23 25 1 0 0 0 0
26 27 1 0 0 0 0
27 28 1 1 0 0 0
29 28 1 1 0 0 0
30 29 1 1 0 0 0
30 31 1 0 0 0 0
31 26 1 0 0 0 0
29 32 1 0 0 0 0
28 33 1 0 0 0 0
27 34 1 0 0 0 0
26 35 1 0 0 0 0
30 19 1 0 0 0 0
S SKP 5
ID FL5FAKGS0001
FORMULA C23H24O12
EXACTMASS 492.126776232
AVERAGEMASS 492.42946
SMILES OC(C1OC(C4=O)=C(Oc(c43)cc(cc3O)O)c(c2)cc(O)c(OC)c2OC)C(C(O)C(C)O1)O
M END
