Mol:FL5FEAGS0024
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 36 39 0 0 0 0 0 0 0 0999 V2000 | + | 36 39 0 0 0 0 0 0 0 0999 V2000 |
| − | 1.9993 2.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9993 2.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9993 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9993 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7138 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7138 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4283 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4283 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4283 2.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4283 2.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7138 2.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7138 2.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2848 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2848 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5704 1.3065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5704 1.3065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1441 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1441 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1441 0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1441 0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5704 -0.3435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5704 -0.3435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2848 0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2848 0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8586 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8586 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5730 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5730 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5730 0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5730 0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8586 -0.3435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8586 -0.3435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5704 -1.0618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5704 -1.0618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2875 1.3065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2875 1.3065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9625 -0.3658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9625 -0.3658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0290 2.4783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0290 2.4783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8586 -1.0430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8586 -1.0430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2392 -0.3156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2392 -0.3156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.7217 2.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7217 2.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6769 0.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6769 0.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5200 -1.4249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5200 -1.4249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9018 0.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9018 0.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7766 -1.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7766 -1.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1892 -1.8636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1892 -1.8636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3957 -1.6368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3957 -1.6368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5974 -1.8461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5974 -1.8461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1847 -1.1314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1847 -1.1314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9783 -1.3581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9783 -1.3581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6020 -2.5440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6020 -2.5440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8747 -2.3215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8747 -2.3215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.7217 -1.7282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.7217 -1.7282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5110 -1.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5110 -1.2937 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 |
| − | 5 20 1 0 0 0 0 | + | 5 20 1 0 0 0 0 |
| − | 16 21 1 0 0 0 0 | + | 16 21 1 0 0 0 0 |
| − | 15 22 1 0 0 0 0 | + | 15 22 1 0 0 0 0 |
| − | 20 23 1 0 0 0 0 | + | 20 23 1 0 0 0 0 |
| − | 19 24 1 0 0 0 0 | + | 19 24 1 0 0 0 0 |
| − | 21 25 1 0 0 0 0 | + | 21 25 1 0 0 0 0 |
| − | 18 26 1 0 0 0 0 | + | 18 26 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 29 1 1 0 0 0 | + | 28 29 1 1 0 0 0 |
| − | 30 29 1 1 0 0 0 | + | 30 29 1 1 0 0 0 |
| − | 31 30 1 1 0 0 0 | + | 31 30 1 1 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | 32 27 1 0 0 0 0 | + | 32 27 1 0 0 0 0 |
| − | 30 33 1 0 0 0 0 | + | 30 33 1 0 0 0 0 |
| − | 29 34 1 0 0 0 0 | + | 29 34 1 0 0 0 0 |
| − | 28 35 1 0 0 0 0 | + | 28 35 1 0 0 0 0 |
| − | 27 36 1 0 0 0 0 | + | 27 36 1 0 0 0 0 |
| − | 31 22 1 0 0 0 0 | + | 31 22 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FEAGS0024 | + | ID FL5FEAGS0024 |
| − | FORMULA C25H28O11 | + | FORMULA C25H28O11 |
| − | EXACTMASS 504.163161738 | + | EXACTMASS 504.163161738 |
| − | AVERAGEMASS 504.48322 | + | AVERAGEMASS 504.48322 |
| − | SMILES C(C)(C(O)1)OC(Oc(c(OC)4)c(OC)c(c2c4)C(C(OC)=C(c(c3)ccc(c3)OC)O2)=O)C(O)C(O)1 | + | SMILES C(C)(C(O)1)OC(Oc(c(OC)4)c(OC)c(c2c4)C(C(OC)=C(c(c3)ccc(c3)OC)O2)=O)C(O)C(O)1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
36 39 0 0 0 0 0 0 0 0999 V2000
1.9993 2.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9993 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7138 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4283 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4283 2.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7138 2.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2848 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5704 1.3065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1441 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1441 0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5704 -0.3435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2848 0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8586 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5730 0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5730 0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8586 -0.3435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5704 -1.0618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2875 1.3065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9625 -0.3658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0290 2.4783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8586 -1.0430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2392 -0.3156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7217 2.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6769 0.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5200 -1.4249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9018 0.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7766 -1.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1892 -1.8636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3957 -1.6368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5974 -1.8461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1847 -1.1314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9783 -1.3581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6020 -2.5440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8747 -2.3215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7217 -1.7282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5110 -1.2937 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
5 20 1 0 0 0 0
16 21 1 0 0 0 0
15 22 1 0 0 0 0
20 23 1 0 0 0 0
19 24 1 0 0 0 0
21 25 1 0 0 0 0
18 26 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 1 0 0 0
30 29 1 1 0 0 0
31 30 1 1 0 0 0
31 32 1 0 0 0 0
32 27 1 0 0 0 0
30 33 1 0 0 0 0
29 34 1 0 0 0 0
28 35 1 0 0 0 0
27 36 1 0 0 0 0
31 22 1 0 0 0 0
S SKP 5
ID FL5FEAGS0024
FORMULA C25H28O11
EXACTMASS 504.163161738
AVERAGEMASS 504.48322
SMILES C(C)(C(O)1)OC(Oc(c(OC)4)c(OC)c(c2c4)C(C(OC)=C(c(c3)ccc(c3)OC)O2)=O)C(O)C(O)1
M END
