Mol:FL2FFCNS0004
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 23 25 0 0 0 0 0 0 0 0999 V2000 | + | 23 25 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.8633 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8633 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8633 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8633 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1489 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1489 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4344 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4344 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4344 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4344 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1489 0.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1489 0.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7199 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7199 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0055 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0055 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0055 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0055 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7199 0.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7199 0.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7530 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7530 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4675 0.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4675 0.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1820 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1820 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1820 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1820 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4675 1.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4675 1.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7530 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7530 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7199 -1.8191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7199 -1.8191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1489 -1.8198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1489 -1.8198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8002 0.2254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8002 0.2254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8706 1.8049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8706 1.8049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5244 1.4274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5244 1.4274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5244 0.5261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5244 0.5261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1489 1.1710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1489 1.1710 0.0000 O 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 |
| − | 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 1 0 0 0 0 | + | 8 9 1 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 |
| − | 9 11 1 6 0 0 0 | + | 9 11 1 6 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 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 13 19 1 0 0 0 0 | + | 13 19 1 0 0 0 0 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 1 22 1 0 0 0 0 | + | 1 22 1 0 0 0 0 |
| − | 6 23 1 0 0 0 0 | + | 6 23 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FFCNS0004 | + | ID FL2FFCNS0004 |
| − | KNApSAcK_ID C00014132 | + | KNApSAcK_ID C00014132 |
| − | NAME 8-Hydroxyhesperetin;5,7,8,3'-Tetrahydroxy-4'-methoxyflavanone | + | NAME 8-Hydroxyhesperetin;5,7,8,3'-Tetrahydroxy-4'-methoxyflavanone |
| − | CAS_RN 460090-60-2 | + | CAS_RN 460090-60-2 |
| − | FORMULA C16H14O7 | + | FORMULA C16H14O7 |
| − | EXACTMASS 318.073952802 | + | EXACTMASS 318.073952802 |
| − | AVERAGEMASS 318.27816 | + | AVERAGEMASS 318.27816 |
| − | SMILES COc(c3)c(O)cc(c3)C(C1)Oc(c(O)2)c(c(O)cc(O)2)C(=O)1 | + | SMILES COc(c3)c(O)cc(c3)C(C1)Oc(c(O)2)c(c(O)cc(O)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/
23 25 0 0 0 0 0 0 0 0999 V2000
-2.8633 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8633 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1489 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4344 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4344 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1489 0.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7199 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0055 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0055 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7199 0.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7530 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4675 0.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1820 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1820 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4675 1.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7530 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7199 -1.8191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1489 -1.8198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8002 0.2254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8706 1.8049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5244 1.4274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5244 0.5261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1489 1.1710 0.0000 O 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
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
9 11 1 6 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
3 18 1 0 0 0 0
13 19 1 0 0 0 0
14 20 1 0 0 0 0
20 21 1 0 0 0 0
1 22 1 0 0 0 0
6 23 1 0 0 0 0
S SKP 8
ID FL2FFCNS0004
KNApSAcK_ID C00014132
NAME 8-Hydroxyhesperetin;5,7,8,3'-Tetrahydroxy-4'-methoxyflavanone
CAS_RN 460090-60-2
FORMULA C16H14O7
EXACTMASS 318.073952802
AVERAGEMASS 318.27816
SMILES COc(c3)c(O)cc(c3)C(C1)Oc(c(O)2)c(c(O)cc(O)2)C(=O)1
M END
