Mol:FL3FACCS0006
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 |
| − | -1.1970 -0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1970 -0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1970 -1.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1970 -1.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5136 -1.4971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5136 -1.4971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1698 -1.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1698 -1.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1698 -0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1698 -0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5136 0.0811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5136 0.0811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8532 -1.4971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8532 -1.4971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5367 -1.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5367 -1.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5367 -0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5367 -0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8532 0.0811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8532 0.0811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8532 -2.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8532 -2.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5136 -2.2861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5136 -2.2861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3718 0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3718 0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0921 -0.2082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0921 -0.2082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8123 0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8123 0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8123 1.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8123 1.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0921 1.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0921 1.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3718 1.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3718 1.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5320 1.4548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5320 1.4548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9421 -0.9493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9421 -0.9493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3087 -1.6588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3087 -1.6588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6751 -1.2787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6751 -1.2787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8137 -1.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8137 -1.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4218 -0.8225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4218 -0.8225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1060 -1.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1060 -1.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5320 -1.1603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5320 -1.1603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0758 -1.6377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0758 -1.6377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9944 -1.9057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9944 -1.9057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8802 0.0810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8802 0.0810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7286 -0.5850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7286 -0.5850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0921 2.2861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0921 2.2861 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 |
| − | 3 12 1 0 0 0 0 | + | 3 12 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 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | 17 18 2 0 0 0 0 | + | 17 18 2 0 0 0 0 |
| − | 18 13 1 0 0 0 0 | + | 18 13 1 0 0 0 0 |
| − | 9 13 1 0 0 0 0 | + | 9 13 1 0 0 0 0 |
| − | 16 19 1 0 0 0 0 | + | 16 19 1 0 0 0 0 |
| − | 20 21 1 1 0 0 0 | + | 20 21 1 1 0 0 0 |
| − | 21 22 1 1 0 0 0 | + | 21 22 1 1 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 20 1 0 0 0 0 | + | 25 20 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 |
| − | 2 23 1 0 0 0 0 | + | 2 23 1 0 0 0 0 |
| − | 1 29 1 0 0 0 0 | + | 1 29 1 0 0 0 0 |
| − | 25 30 1 0 0 0 0 | + | 25 30 1 0 0 0 0 |
| − | 17 31 1 0 0 0 0 | + | 17 31 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL3FACCS0006 | + | ID FL3FACCS0006 |
| − | FORMULA C21H20O10 | + | FORMULA C21H20O10 |
| − | EXACTMASS 432.10564686 | + | EXACTMASS 432.10564686 |
| − | AVERAGEMASS 432.37749999999994 | + | AVERAGEMASS 432.37749999999994 |
| − | SMILES c(c1)c(C(=C4)Oc(c3)c(C(=O)4)c(c(c(O)3)C(C(O)2)OC(C)C(O)C2O)O)cc(c(O)1)O | + | SMILES c(c1)c(C(=C4)Oc(c3)c(C(=O)4)c(c(c(O)3)C(C(O)2)OC(C)C(O)C2O)O)cc(c(O)1)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/
31 34 0 0 0 0 0 0 0 0999 V2000
-1.1970 -0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1970 -1.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5136 -1.4971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1698 -1.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1698 -0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5136 0.0811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8532 -1.4971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5367 -1.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5367 -0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8532 0.0811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8532 -2.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5136 -2.2861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3718 0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0921 -0.2082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8123 0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8123 1.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0921 1.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3718 1.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5320 1.4548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9421 -0.9493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3087 -1.6588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6751 -1.2787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8137 -1.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4218 -0.8225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1060 -1.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5320 -1.1603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0758 -1.6377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9944 -1.9057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8802 0.0810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7286 -0.5850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0921 2.2861 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
3 12 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 17 1 0 0 0 0
17 18 2 0 0 0 0
18 13 1 0 0 0 0
9 13 1 0 0 0 0
16 19 1 0 0 0 0
20 21 1 1 0 0 0
21 22 1 1 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 20 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
2 23 1 0 0 0 0
1 29 1 0 0 0 0
25 30 1 0 0 0 0
17 31 1 0 0 0 0
S SKP 5
ID FL3FACCS0006
FORMULA C21H20O10
EXACTMASS 432.10564686
AVERAGEMASS 432.37749999999994
SMILES c(c1)c(C(=C4)Oc(c3)c(C(=O)4)c(c(c(O)3)C(C(O)2)OC(C)C(O)C2O)O)cc(c(O)1)O
M END
