Mol:FL5FG9NS0008
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 24 26 0 0 0 0 0 0 0 0999 V2000 | + | 24 26 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.4320 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4320 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4320 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4320 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1465 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1465 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8609 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8609 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8609 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8609 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1465 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1465 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2825 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2825 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9970 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9970 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9969 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9969 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2825 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2825 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7113 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7113 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4258 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4258 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1402 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1402 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1402 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1402 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4258 1.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4258 1.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7113 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7113 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2825 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2825 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5754 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5754 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7114 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7114 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4247 -0.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4247 -0.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1465 -1.7773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1465 -1.7773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1465 1.3418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1465 1.3418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5008 -0.9883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5008 -0.9883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1402 -0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1402 -0.6191 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 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 6 21 1 0 0 0 0 | + | 6 21 1 0 0 0 0 |
| − | 3 22 1 0 0 0 0 | + | 3 22 1 0 0 0 0 |
| − | 5 23 1 0 0 0 0 | + | 5 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FG9NS0008 | + | ID FL5FG9NS0008 |
| − | KNApSAcK_ID C00013352 | + | KNApSAcK_ID C00013352 |
| − | NAME 5,7,8-Trihydroxy-3,6-dimethoxyflavone | + | NAME 5,7,8-Trihydroxy-3,6-dimethoxyflavone |
| − | CAS_RN - | + | CAS_RN - |
| − | FORMULA C17H14O7 | + | FORMULA C17H14O7 |
| − | EXACTMASS 330.073952802 | + | EXACTMASS 330.073952802 |
| − | AVERAGEMASS 330.28886 | + | AVERAGEMASS 330.28886 |
| − | SMILES COc(c(O)1)c(O)c(C(=O)2)c(OC(c(c3)cccc3)=C(OC)2)c(O)1 | + | SMILES COc(c(O)1)c(O)c(C(=O)2)c(OC(c(c3)cccc3)=C(OC)2)c(O)1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
24 26 0 0 0 0 0 0 0 0999 V2000
-0.4320 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4320 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1465 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8609 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8609 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1465 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2825 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9970 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9969 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2825 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7113 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4258 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1402 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1402 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4258 1.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7113 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2825 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5754 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7114 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4247 -0.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1465 -1.7773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1465 1.3418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5008 -0.9883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1402 -0.6191 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
19 20 1 0 0 0 0
6 21 1 0 0 0 0
3 22 1 0 0 0 0
5 23 1 0 0 0 0
23 24 1 0 0 0 0
S SKP 8
ID FL5FG9NS0008
KNApSAcK_ID C00013352
NAME 5,7,8-Trihydroxy-3,6-dimethoxyflavone
CAS_RN -
FORMULA C17H14O7
EXACTMASS 330.073952802
AVERAGEMASS 330.28886
SMILES COc(c(O)1)c(O)c(C(=O)2)c(OC(c(c3)cccc3)=C(OC)2)c(O)1
M END
