Mol:FL5FALNS0020
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 30 32 0 0 0 0 0 0 0 0999 V2000 | + | 30 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.0717 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 -1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 -1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2151 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2151 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 -2.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 -2.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9296 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9296 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9296 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9296 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 2.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 2.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 -1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 -1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 2.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 2.2687 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 |
| − | 1 7 1 0 0 0 0 | + | 1 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 2 1 0 0 0 0 | + | 10 2 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 |
| − | 4 18 1 0 0 0 0 | + | 4 18 1 0 0 0 0 |
| − | 8 19 1 0 0 0 0 | + | 8 19 1 0 0 0 0 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 6 21 1 0 0 0 0 | + | 6 21 1 0 0 0 0 |
| − | 19 22 1 0 0 0 0 | + | 19 22 1 0 0 0 0 |
| − | 18 23 1 0 0 0 0 | + | 18 23 1 0 0 0 0 |
| − | 13 24 1 0 0 0 0 | + | 13 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 20 26 1 0 0 0 0 | + | 20 26 1 0 0 0 0 |
| − | 12 27 1 0 0 0 0 | + | 12 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 16 29 1 0 0 0 0 | + | 16 29 1 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FALNS0020 | + | ID FL5FALNS0020 |
| − | KNApSAcK_ID C00013383 | + | KNApSAcK_ID C00013383 |
| − | NAME 5-Hydroxy-3,7,2',3',4',6'-hexamethoxyflavone;5-Hydroxy-3,7-dimethoxy-2-(2,3,4,6-tetramethoxyphenyl)- 4H-1-benzopyran-4-one | + | NAME 5-Hydroxy-3,7,2',3',4',6'-hexamethoxyflavone;5-Hydroxy-3,7-dimethoxy-2-(2,3,4,6-tetramethoxyphenyl)- 4H-1-benzopyran-4-one |
| − | CAS_RN 149474-89-5 | + | CAS_RN 149474-89-5 |
| − | FORMULA C21H22O9 | + | FORMULA C21H22O9 |
| − | EXACTMASS 418.126382302 | + | EXACTMASS 418.126382302 |
| − | AVERAGEMASS 418.39398 | + | AVERAGEMASS 418.39398 |
| − | SMILES COc(c1OC)cc(c(C(O3)=C(C(=O)c(c32)c(cc(OC)c2)O)OC)c(OC)1)OC | + | SMILES COc(c1OC)cc(c(C(O3)=C(C(=O)c(c32)c(cc(OC)c2)O)OC)c(OC)1)OC |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
30 32 0 0 0 0 0 0 0 0999 V2000
-1.0717 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 -2.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9296 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9296 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 2.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 -1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 2.2687 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
1 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 2 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
4 18 1 0 0 0 0
8 19 1 0 0 0 0
14 20 1 0 0 0 0
6 21 1 0 0 0 0
19 22 1 0 0 0 0
18 23 1 0 0 0 0
13 24 1 0 0 0 0
24 25 1 0 0 0 0
20 26 1 0 0 0 0
12 27 1 0 0 0 0
27 28 1 0 0 0 0
16 29 1 0 0 0 0
29 30 1 0 0 0 0
S SKP 8
ID FL5FALNS0020
KNApSAcK_ID C00013383
NAME 5-Hydroxy-3,7,2',3',4',6'-hexamethoxyflavone;5-Hydroxy-3,7-dimethoxy-2-(2,3,4,6-tetramethoxyphenyl)- 4H-1-benzopyran-4-one
CAS_RN 149474-89-5
FORMULA C21H22O9
EXACTMASS 418.126382302
AVERAGEMASS 418.39398
SMILES COc(c1OC)cc(c(C(O3)=C(C(=O)c(c32)c(cc(OC)c2)O)OC)c(OC)1)OC
M END
