Mol:FLIAALNF0005
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 27 30 0 0 0 0 0 0 0 0999 V2000 | + | 27 30 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.6936 -0.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6936 -0.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6936 -0.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6936 -0.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1373 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1373 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5810 -0.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5810 -0.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5810 -0.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5810 -0.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1373 0.2151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1373 0.2151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0247 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0247 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5316 -0.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5316 -0.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5316 -0.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5316 -0.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0247 0.2151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0247 0.2151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0877 -1.0695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0877 -1.0695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0877 -1.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0877 -1.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6825 -2.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6825 -2.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2773 -1.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2773 -1.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2773 -1.0695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2773 -1.0695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6825 -0.7261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6825 -0.7261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0247 -1.7117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0247 -1.7117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1373 -1.7117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1373 -1.7117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2708 0.8434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2708 0.8434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9097 0.9106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9097 0.9106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1710 0.3237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1710 0.3237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2307 1.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2307 1.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9104 2.0216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9104 2.0216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8715 1.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8715 1.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5962 2.0997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5962 2.0997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6825 -0.0400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6825 -0.0400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8715 -2.0994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8715 -2.0994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 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 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 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 8 11 1 0 0 0 0 | + | 8 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 11 2 0 0 0 0 | + | 16 11 2 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 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 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 1 1 0 0 0 0 | + | 21 1 1 0 0 0 0 |
| − | 20 22 1 0 0 0 0 | + | 20 22 1 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 |
| − | 22 25 1 0 0 0 0 | + | 22 25 1 0 0 0 0 |
| − | 16 26 1 0 0 0 0 | + | 16 26 1 0 0 0 0 |
| − | 14 27 1 0 0 0 0 | + | 14 27 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIAALNF0005 | + | ID FLIAALNF0005 |
| − | KNApSAcK_ID C00009910 | + | KNApSAcK_ID C00009910 |
| − | NAME Lunatone | + | NAME Lunatone |
| − | CAS_RN 104363-13-5 | + | CAS_RN 104363-13-5 |
| − | FORMULA C20H18O7 | + | FORMULA C20H18O7 |
| − | EXACTMASS 370.10525293 | + | EXACTMASS 370.10525293 |
| − | AVERAGEMASS 370.35272 | + | AVERAGEMASS 370.35272 |
| − | SMILES C(c41)C(C(C)(C)O)Oc1cc(c(c42)C(C(c(c3)c(O)cc(O)c3)=CO2)=O)O | + | SMILES C(c41)C(C(C)(C)O)Oc1cc(c(c42)C(C(c(c3)c(O)cc(O)c3)=CO2)=O)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
27 30 0 0 0 0 0 0 0 0999 V2000
-1.6936 -0.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6936 -0.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1373 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5810 -0.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5810 -0.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1373 0.2151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0247 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5316 -0.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5316 -0.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0247 0.2151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0877 -1.0695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0877 -1.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6825 -2.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2773 -1.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2773 -1.0695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6825 -0.7261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0247 -1.7117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1373 -1.7117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2708 0.8434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9097 0.9106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1710 0.3237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2307 1.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9104 2.0216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8715 1.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5962 2.0997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6825 -0.0400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8715 -2.0994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 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 5 1 0 0 0 0
8 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 11 2 0 0 0 0
1 2 1 0 0 0 0
7 17 2 0 0 0 0
3 18 1 0 0 0 0
6 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
21 1 1 0 0 0 0
20 22 1 0 0 0 0
22 23 1 0 0 0 0
22 24 1 0 0 0 0
22 25 1 0 0 0 0
16 26 1 0 0 0 0
14 27 1 0 0 0 0
S SKP 8
ID FLIAALNF0005
KNApSAcK_ID C00009910
NAME Lunatone
CAS_RN 104363-13-5
FORMULA C20H18O7
EXACTMASS 370.10525293
AVERAGEMASS 370.35272
SMILES C(c41)C(C(C)(C)O)Oc1cc(c(c42)C(C(c(c3)c(O)cc(O)c3)=CO2)=O)O
M END
