Mol:FLIA19NM0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 19 21 0 0 0 0 0 0 0 0999 V2000 | + | 19 21 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.7074 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7074 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7074 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7074 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1511 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1511 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5948 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5948 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5948 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5948 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1511 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1511 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0385 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0385 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5178 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5178 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5178 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5178 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0385 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0385 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2635 1.1573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2635 1.1573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0739 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0739 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0739 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0739 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6687 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6687 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2635 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2635 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2635 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2635 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6687 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6687 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0739 1.1573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0739 1.1573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0385 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0385 -0.7694 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 |
| − | 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 |
| − | 1 11 1 0 0 0 0 | + | 1 11 1 0 0 0 0 |
| − | 8 12 1 0 0 0 0 | + | 8 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 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
| − | 9 18 1 0 0 0 0 | + | 9 18 1 0 0 0 0 |
| − | 7 19 2 0 0 0 0 | + | 7 19 2 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIA19NM0001 | + | ID FLIA19NM0001 |
| − | KNApSAcK_ID C00009379 | + | KNApSAcK_ID C00009379 |
| − | NAME 7-Hydroxy-2-methylisoflavone | + | NAME 7-Hydroxy-2-methylisoflavone |
| − | CAS_RN 2859-88-3 | + | CAS_RN 2859-88-3 |
| − | FORMULA C16H12O3 | + | FORMULA C16H12O3 |
| − | EXACTMASS 252.07864425 | + | EXACTMASS 252.07864425 |
| − | AVERAGEMASS 252.26468 | + | AVERAGEMASS 252.26468 |
| − | SMILES Oc(c3)cc(O2)c(c3)C(=O)C(=C(C)2)c(c1)cccc1 | + | SMILES Oc(c3)cc(O2)c(c3)C(=O)C(=C(C)2)c(c1)cccc1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
19 21 0 0 0 0 0 0 0 0999 V2000
-1.7074 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7074 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1511 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5948 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5948 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1511 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0385 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5178 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5178 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0385 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2635 1.1573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0739 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0739 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6687 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2635 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2635 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6687 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0739 1.1573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0385 -0.7694 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
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
1 11 1 0 0 0 0
8 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 17 2 0 0 0 0
17 12 1 0 0 0 0
9 18 1 0 0 0 0
7 19 2 0 0 0 0
S SKP 8
ID FLIA19NM0001
KNApSAcK_ID C00009379
NAME 7-Hydroxy-2-methylisoflavone
CAS_RN 2859-88-3
FORMULA C16H12O3
EXACTMASS 252.07864425
AVERAGEMASS 252.26468
SMILES Oc(c3)cc(O2)c(c3)C(=O)C(=C(C)2)c(c1)cccc1
M END
