Mol:FLIG1LNF0001
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 31 0 0 0 0 0 0 0 0999 V2000 | + | 27 31 0 0 0 0 0 0 0 0999 V2000 |
| − | -3.0632 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0632 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0632 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0632 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5069 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5069 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9506 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9506 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9506 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9506 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5069 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5069 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3943 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3943 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8380 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8380 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3943 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3943 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2819 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2819 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2819 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2819 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3128 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3128 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9076 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9076 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9076 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9076 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3128 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3128 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8380 0.8360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8380 0.8360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6193 1.1573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6193 1.1573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5069 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5069 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3193 0.8362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3193 0.8362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3943 -0.7519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3943 -0.7519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5608 -1.0262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5608 -1.0262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9645 -0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9645 -0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5608 0.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5608 0.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6506 -0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6506 -0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9937 -1.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9937 -1.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9937 0.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9937 0.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6193 -0.4706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6193 -0.4706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 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 |
| − | 9 5 1 0 0 0 0 | + | 9 5 1 0 0 0 0 |
| − | 8 10 1 0 0 0 0 | + | 8 10 1 0 0 0 0 |
| − | 10 11 2 0 0 0 0 | + | 10 11 2 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 10 1 0 0 0 0 | + | 15 10 1 0 0 0 0 |
| − | 8 16 2 0 0 0 0 | + | 8 16 2 0 0 0 0 |
| − | 16 9 1 0 0 0 0 | + | 16 9 1 0 0 0 0 |
| − | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 16 19 1 0 0 0 0 | + | 16 19 1 0 0 0 0 |
| − | 19 15 1 0 0 0 0 | + | 19 15 1 0 0 0 0 |
| − | 7 20 2 0 0 0 0 | + | 7 20 2 0 0 0 0 |
| − | 13 21 1 0 0 0 0 | + | 13 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 14 1 0 0 0 0 | + | 23 14 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
| − | 24 27 1 0 0 0 0 | + | 24 27 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIG1LNF0001 | + | ID FLIG1LNF0001 |
| − | KNApSAcK_ID C00010065 | + | KNApSAcK_ID C00010065 |
| − | NAME Lupinalbin E | + | NAME Lupinalbin E |
| − | CAS_RN 98113-95-2 | + | CAS_RN 98113-95-2 |
| − | FORMULA C20H16O7 | + | FORMULA C20H16O7 |
| − | EXACTMASS 368.089602866 | + | EXACTMASS 368.089602866 |
| − | AVERAGEMASS 368.33684000000005 | + | AVERAGEMASS 368.33684000000005 |
| − | SMILES C(c51)C(Oc1ccc(c54)c(c3o4)C(=O)c(c(O3)2)c(cc(O)c2)O)C(C)(C)O | + | SMILES C(c51)C(Oc1ccc(c54)c(c3o4)C(=O)c(c(O3)2)c(cc(O)c2)O)C(C)(C)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
27 31 0 0 0 0 0 0 0 0999 V2000
-3.0632 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0632 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5069 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9506 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9506 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5069 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3943 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8380 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3943 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2819 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2819 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3128 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9076 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9076 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3128 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8380 0.8360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6193 1.1573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5069 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3193 0.8362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3943 -0.7519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5608 -1.0262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9645 -0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5608 0.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6506 -0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9937 -1.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9937 0.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6193 -0.4706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 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
9 5 1 0 0 0 0
8 10 1 0 0 0 0
10 11 2 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 10 1 0 0 0 0
8 16 2 0 0 0 0
16 9 1 0 0 0 0
1 17 1 0 0 0 0
3 18 1 0 0 0 0
16 19 1 0 0 0 0
19 15 1 0 0 0 0
7 20 2 0 0 0 0
13 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 14 1 0 0 0 0
22 24 1 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
24 27 1 0 0 0 0
S SKP 8
ID FLIG1LNF0001
KNApSAcK_ID C00010065
NAME Lupinalbin E
CAS_RN 98113-95-2
FORMULA C20H16O7
EXACTMASS 368.089602866
AVERAGEMASS 368.33684000000005
SMILES C(c51)C(Oc1ccc(c54)c(c3o4)C(=O)c(c(O3)2)c(cc(O)c2)O)C(C)(C)O
M END
