Mol:FLIAA9NS0003
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 |
| − | 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 |
| − | -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 |
| − | -0.0385 -0.7727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0385 -0.7727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1511 -0.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1511 -0.7694 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 |
| − | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
| − | 7 18 2 0 0 0 0 | + | 7 18 2 0 0 0 0 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIAA9NS0003 | + | ID FLIAA9NS0003 |
| − | KNApSAcK_ID C00009814 | + | KNApSAcK_ID C00009814 |
| − | NAME 5,7-Dihydroxyisoflavone | + | NAME 5,7-Dihydroxyisoflavone |
| − | CAS_RN 4044-00-2 | + | CAS_RN 4044-00-2 |
| − | FORMULA C15H10O4 | + | FORMULA C15H10O4 |
| − | EXACTMASS 254.05790880799998 | + | EXACTMASS 254.05790880799998 |
| − | AVERAGEMASS 254.2375 | + | AVERAGEMASS 254.2375 |
| − | SMILES Oc(c3)cc(O2)c(c(O)3)C(=O)C(=C2)c(c1)cccc1 | + | SMILES Oc(c3)cc(O2)c(c(O)3)C(=O)C(=C2)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
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
-2.2635 1.1573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0385 -0.7727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1511 -0.7694 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
1 17 1 0 0 0 0
7 18 2 0 0 0 0
3 19 1 0 0 0 0
S SKP 8
ID FLIAA9NS0003
KNApSAcK_ID C00009814
NAME 5,7-Dihydroxyisoflavone
CAS_RN 4044-00-2
FORMULA C15H10O4
EXACTMASS 254.05790880799998
AVERAGEMASS 254.2375
SMILES Oc(c3)cc(O2)c(c(O)3)C(=O)C(=C2)c(c1)cccc1
M END
