Mol:FL1D1ANI0002
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 30 0 0 0 0 0 0 0 0999 V2000 | + | 29 30 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.6173 0.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6173 0.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6173 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6173 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1526 -0.2883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1526 -0.2883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3122 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3122 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3122 0.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3122 0.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1526 0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1526 0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1849 -0.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1849 -0.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6493 0.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6493 0.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1137 -0.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1137 -0.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5769 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5769 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1137 -0.8024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1137 -0.8024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5769 0.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5769 0.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0604 0.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0604 0.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5440 0.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5440 0.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5440 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5440 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0604 -0.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0604 -0.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0604 -0.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0604 -0.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0274 0.8374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0274 0.8374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7766 0.7848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7766 0.7848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7766 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7766 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2410 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2410 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7054 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7054 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1698 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1698 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7054 -0.8244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7054 -0.8244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6342 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6342 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0986 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0986 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5630 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5630 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0274 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0274 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5630 -0.8244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5630 -0.8244 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 |
| − | 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 |
| − | 9 11 2 0 0 0 0 | + | 9 11 2 0 0 0 0 |
| − | 2 7 1 0 0 0 0 | + | 2 7 1 0 0 0 0 |
| − | 10 12 2 0 0 0 0 | + | 10 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 10 1 0 0 0 0 | + | 16 10 1 0 0 0 0 |
| − | 16 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 5 19 1 0 0 0 0 | + | 5 19 1 0 0 0 0 |
| − | 4 20 1 0 0 0 0 | + | 4 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 2 0 0 0 0 | + | 26 27 2 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 27 29 1 0 0 0 0 | + | 27 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL1D1ANI0002 | + | ID FL1D1ANI0002 |
| − | KNApSAcK_ID C00008014 | + | KNApSAcK_ID C00008014 |
| − | NAME 3-Geranyl-4,2',4'-trihydroxydihydrochalcone | + | NAME 3-Geranyl-4,2',4'-trihydroxydihydrochalcone |
| − | CAS_RN - | + | CAS_RN - |
| − | FORMULA C25H30O4 | + | FORMULA C25H30O4 |
| − | EXACTMASS 394.21440944799997 | + | EXACTMASS 394.21440944799997 |
| − | AVERAGEMASS 394.50329999999997 | + | AVERAGEMASS 394.50329999999997 |
| − | SMILES c(c1CCC(=O)c(c2O)ccc(c2)O)c(CC=C(C)CCC=C(C)C)c(O)cc1 | + | SMILES c(c1CCC(=O)c(c2O)ccc(c2)O)c(CC=C(C)CCC=C(C)C)c(O)cc1 |
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 30 0 0 0 0 0 0 0 0999 V2000
-0.6173 0.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6173 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1526 -0.2883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3122 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3122 0.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1526 0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1849 -0.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6493 0.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1137 -0.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5769 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1137 -0.8024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5769 0.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0604 0.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5440 0.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5440 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0604 -0.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0604 -0.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0274 0.8374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7766 0.7848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7766 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2410 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7054 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1698 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7054 -0.8244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6342 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0986 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5630 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0274 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5630 -0.8244 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
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
9 11 2 0 0 0 0
2 7 1 0 0 0 0
10 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 10 1 0 0 0 0
16 17 1 0 0 0 0
14 18 1 0 0 0 0
5 19 1 0 0 0 0
4 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 2 0 0 0 0
22 23 1 0 0 0 0
22 24 1 0 0 0 0
23 25 1 0 0 0 0
25 26 1 0 0 0 0
26 27 2 0 0 0 0
27 28 1 0 0 0 0
27 29 1 0 0 0 0
S SKP 8
ID FL1D1ANI0002
KNApSAcK_ID C00008014
NAME 3-Geranyl-4,2',4'-trihydroxydihydrochalcone
CAS_RN -
FORMULA C25H30O4
EXACTMASS 394.21440944799997
AVERAGEMASS 394.50329999999997
SMILES c(c1CCC(=O)c(c2O)ccc(c2)O)c(CC=C(C)CCC=C(C)C)c(O)cc1
M END
