Mol:FL3FGGNS0012
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 29 31 0 0 0 0 0 0 0 0999 V2000 | + | 29 31 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.0717 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 -0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7861 0.0746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7861 0.0746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 -0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7861 -1.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7861 -1.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -1.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -1.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3573 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3573 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -0.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -0.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 0.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 0.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 0.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 0.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 -0.3377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 -0.3377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 0.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 0.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 0.8998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 0.8998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7861 1.3123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7861 1.3123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 0.8998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 0.8998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -2.4004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -2.4004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 -0.3377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 -0.3377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7861 -2.4004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7861 -2.4004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2151 0.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2151 0.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7861 0.8996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7861 0.8996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 1.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 1.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2151 -1.5754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2151 -1.5754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9295 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9295 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1632 1.2823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1632 1.2823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9284 -0.3372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9284 -0.3372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9295 0.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9295 0.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7861 2.0381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7861 2.0381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1586 2.4004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1586 2.4004 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 |
| − | 13 18 1 0 0 0 0 | + | 13 18 1 0 0 0 0 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 4 20 1 0 0 0 0 | + | 4 20 1 0 0 0 0 |
| − | 3 21 1 0 0 0 0 | + | 3 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 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 |
| − | 14 25 1 0 0 0 0 | + | 14 25 1 0 0 0 0 |
| − | 20 26 1 0 0 0 0 | + | 20 26 1 0 0 0 0 |
| − | 18 27 1 0 0 0 0 | + | 18 27 1 0 0 0 0 |
| − | 15 28 1 0 0 0 0 | + | 15 28 1 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FGGNS0012 | + | ID FL3FGGNS0012 |
| − | KNApSAcK_ID C00013347 | + | KNApSAcK_ID C00013347 |
| − | NAME 5,4'-Dihydroxy-6,7,8,3',5'-pentamethoxyflavone;5-Hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-6,7,8-trimethoxy-4H-1-benzopyran-4-one | + | NAME 5,4'-Dihydroxy-6,7,8,3',5'-pentamethoxyflavone;5-Hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-6,7,8-trimethoxy-4H-1-benzopyran-4-one |
| − | CAS_RN 240804-39-1 | + | CAS_RN 240804-39-1 |
| − | FORMULA C20H20O9 | + | FORMULA C20H20O9 |
| − | EXACTMASS 404.11073223799997 | + | EXACTMASS 404.11073223799997 |
| − | AVERAGEMASS 404.3674 | + | AVERAGEMASS 404.3674 |
| − | SMILES O(C)c(c31)c(c(c(c(C(=O)C=C(O3)c(c2)cc(OC)c(O)c2OC)1)O)OC)OC | + | SMILES O(C)c(c31)c(c(c(c(C(=O)C=C(O3)c(c2)cc(OC)c(O)c2OC)1)O)OC)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/
29 31 0 0 0 0 0 0 0 0999 V2000
-1.0717 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 0.0746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 -1.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -1.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3573 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -0.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 0.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 -0.3377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 0.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 0.8998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7861 1.3123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.8998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -2.4004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 -0.3377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 -2.4004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 0.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 0.8996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 1.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 -1.5754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9295 -1.1629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1632 1.2823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9284 -0.3372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9295 0.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7861 2.0381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1586 2.4004 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
13 18 1 0 0 0 0
6 19 1 0 0 0 0
4 20 1 0 0 0 0
3 21 1 0 0 0 0
21 22 1 0 0 0 0
5 23 1 0 0 0 0
23 24 1 0 0 0 0
14 25 1 0 0 0 0
20 26 1 0 0 0 0
18 27 1 0 0 0 0
15 28 1 0 0 0 0
28 29 1 0 0 0 0
S SKP 8
ID FL3FGGNS0012
KNApSAcK_ID C00013347
NAME 5,4'-Dihydroxy-6,7,8,3',5'-pentamethoxyflavone;5-Hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-6,7,8-trimethoxy-4H-1-benzopyran-4-one
CAS_RN 240804-39-1
FORMULA C20H20O9
EXACTMASS 404.11073223799997
AVERAGEMASS 404.3674
SMILES O(C)c(c31)c(c(c(c(C(=O)C=C(O3)c(c2)cc(OC)c(O)c2OC)1)O)OC)OC
M END
