Mol:FL5FEANS0021
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 25 27 0 0 0 0 0 0 0 0999 V2000 | + | 25 27 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.0608 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0608 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0608 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0608 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7752 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7752 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4897 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4897 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4897 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4897 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7752 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7752 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3463 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3463 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3682 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3682 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3681 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3681 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3463 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3463 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0826 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0826 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7970 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7970 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5115 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5115 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5115 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5115 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7970 1.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7970 1.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0825 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0825 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3463 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3463 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2042 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2042 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0827 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0827 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7959 -0.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7959 -0.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7752 -1.7773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7752 -1.7773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1296 -0.9883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1296 -0.9883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2149 1.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2149 1.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9175 1.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9175 1.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9175 0.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9175 0.2068 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 |
| − | 5 22 1 0 0 0 0 | + | 5 22 1 0 0 0 0 |
| − | 14 23 1 0 0 0 0 | + | 14 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 18 25 1 0 0 0 0 | + | 18 25 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FEANS0021 | + | ID FL5FEANS0021 |
| − | KNApSAcK_ID C00013354 | + | KNApSAcK_ID C00013354 |
| − | NAME 5,6-Dihydroxy-3,7,4'-trimethoxyflavone;6-Hydroxykaempferol 3,7,4'-trimethyl ether;Tanetin;5,6-Dihydroxy-3,7-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one | + | NAME 5,6-Dihydroxy-3,7,4'-trimethoxyflavone;6-Hydroxykaempferol 3,7,4'-trimethyl ether;Tanetin;5,6-Dihydroxy-3,7-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 84019-17-0 | + | CAS_RN 84019-17-0 |
| − | FORMULA C18H16O7 | + | FORMULA C18H16O7 |
| − | EXACTMASS 344.089602866 | + | EXACTMASS 344.089602866 |
| − | AVERAGEMASS 344.31543999999997 | + | AVERAGEMASS 344.31543999999997 |
| − | SMILES c(c3O)(OC)cc(O1)c(c3O)C(C(=C1c(c2)ccc(OC)c2)OC)=O | + | SMILES c(c3O)(OC)cc(O1)c(c3O)C(C(=C1c(c2)ccc(OC)c2)OC)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
25 27 0 0 0 0 0 0 0 0999 V2000
-1.0608 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0608 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7752 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4897 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4897 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7752 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3463 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3682 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3681 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3463 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0826 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7970 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5115 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5115 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7970 1.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0825 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3463 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2042 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0827 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7959 -0.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7752 -1.7773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1296 -0.9883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2149 1.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9175 1.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9175 0.2068 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
5 22 1 0 0 0 0
14 23 1 0 0 0 0
23 24 1 0 0 0 0
18 25 1 0 0 0 0
S SKP 8
ID FL5FEANS0021
KNApSAcK_ID C00013354
NAME 5,6-Dihydroxy-3,7,4'-trimethoxyflavone;6-Hydroxykaempferol 3,7,4'-trimethyl ether;Tanetin;5,6-Dihydroxy-3,7-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 84019-17-0
FORMULA C18H16O7
EXACTMASS 344.089602866
AVERAGEMASS 344.31543999999997
SMILES c(c3O)(OC)cc(O1)c(c3O)C(C(=C1c(c2)ccc(OC)c2)OC)=O
M END
