Mol:FL2FF9GS0004
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 32 35 0 0 0 0 0 0 0 0999 V2000 | + | 32 35 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.6164 1.2190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6164 1.2190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9038 1.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9038 1.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6132 0.3940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6132 0.3940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8965 -0.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8965 -0.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1837 0.4004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1837 0.4004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1874 1.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1874 1.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5326 -0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5326 -0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2452 0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2452 0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2415 1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2415 1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5252 1.6411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5252 1.6411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8953 1.6126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8953 1.6126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6114 1.2028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6114 1.2028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3242 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3242 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3211 2.4431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3211 2.4431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6050 2.8529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6050 2.8529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8921 2.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8921 2.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5336 -0.6522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5336 -0.6522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2419 1.5802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2419 1.5802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8965 -0.7399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8965 -0.7399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9038 2.3832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9038 2.3832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8995 1.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8995 1.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6182 2.7957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6182 2.7957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4772 -1.5196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4772 -1.5196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8898 -2.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8898 -2.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0963 -2.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0963 -2.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2980 -2.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2980 -2.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8853 -1.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8853 -1.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6789 -1.7288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6789 -1.7288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3026 -2.8529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3026 -2.8529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5092 -2.5902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5092 -2.5902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3242 -2.0222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3242 -2.0222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0673 -1.4994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0673 -1.4994 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 |
| − | 1 3 1 0 0 0 0 | + | 1 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 2 1 0 0 0 0 | + | 6 2 1 0 0 0 0 |
| − | 5 7 1 0 0 0 0 | + | 5 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 6 1 0 0 0 0 | + | 10 6 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 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 |
| − | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 4 19 1 0 0 0 0 | + | 4 19 1 0 0 0 0 |
| − | 2 20 1 0 0 0 0 | + | 2 20 1 0 0 0 0 |
| − | 18 21 1 0 0 0 0 | + | 18 21 1 0 0 0 0 |
| − | 20 22 1 0 0 0 0 | + | 20 22 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 25 1 1 0 0 0 | + | 24 25 1 1 0 0 0 |
| − | 26 25 1 1 0 0 0 | + | 26 25 1 1 0 0 0 |
| − | 27 26 1 1 0 0 0 | + | 27 26 1 1 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 23 1 0 0 0 0 | + | 28 23 1 0 0 0 0 |
| − | 26 29 1 0 0 0 0 | + | 26 29 1 0 0 0 0 |
| − | 25 30 1 0 0 0 0 | + | 25 30 1 0 0 0 0 |
| − | 24 31 1 0 0 0 0 | + | 24 31 1 0 0 0 0 |
| − | 23 32 1 0 0 0 0 | + | 23 32 1 0 0 0 0 |
| − | 27 19 1 0 0 0 0 | + | 27 19 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL2FF9GS0004 | + | ID FL2FF9GS0004 |
| − | FORMULA C23H26O9 | + | FORMULA C23H26O9 |
| − | EXACTMASS 446.15768243 | + | EXACTMASS 446.15768243 |
| − | AVERAGEMASS 446.44714 | + | AVERAGEMASS 446.44714 |
| − | SMILES c(c(OC)3)c(OC(O4)C(C(C(O)C4C)O)O)c(C2=O)c(c3OC)OC(C2)c(c1)cccc1 | + | SMILES c(c(OC)3)c(OC(O4)C(C(C(O)C4C)O)O)c(C2=O)c(c3OC)OC(C2)c(c1)cccc1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
32 35 0 0 0 0 0 0 0 0999 V2000
-1.6164 1.2190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9038 1.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6132 0.3940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8965 -0.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1837 0.4004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1874 1.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5326 -0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2452 0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2415 1.2317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5252 1.6411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8953 1.6126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6114 1.2028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3242 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3211 2.4431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6050 2.8529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8921 2.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5336 -0.6522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2419 1.5802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8965 -0.7399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9038 2.3832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8995 1.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6182 2.7957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4772 -1.5196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8898 -2.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0963 -2.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2980 -2.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8853 -1.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6789 -1.7288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3026 -2.8529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5092 -2.5902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3242 -2.0222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0673 -1.4994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 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 2 1 0 0 0 0
5 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 6 1 0 0 0 0
9 11 1 0 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
7 17 2 0 0 0 0
1 18 1 0 0 0 0
4 19 1 0 0 0 0
2 20 1 0 0 0 0
18 21 1 0 0 0 0
20 22 1 0 0 0 0
23 24 1 0 0 0 0
24 25 1 1 0 0 0
26 25 1 1 0 0 0
27 26 1 1 0 0 0
27 28 1 0 0 0 0
28 23 1 0 0 0 0
26 29 1 0 0 0 0
25 30 1 0 0 0 0
24 31 1 0 0 0 0
23 32 1 0 0 0 0
27 19 1 0 0 0 0
S SKP 5
ID FL2FF9GS0004
FORMULA C23H26O9
EXACTMASS 446.15768243
AVERAGEMASS 446.44714
SMILES c(c(OC)3)c(OC(O4)C(C(C(O)C4C)O)O)c(C2=O)c(c3OC)OC(C2)c(c1)cccc1
M END
