Mol:FL3FACNI0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 26 28 0 0 0 0 0 0 0 0999 V2000 | + | 26 28 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.9499 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9499 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9499 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9499 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3936 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3936 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8373 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8373 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8373 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8373 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3936 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3936 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2810 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2810 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2753 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2753 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2753 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2753 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2810 0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2810 0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2810 -1.7854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2810 -1.7854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8314 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8314 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3983 -0.3273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3983 -0.3273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9653 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9653 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9653 0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9653 0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3983 0.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3983 0.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8314 0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8314 0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3936 -1.9267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3936 -1.9267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3936 0.6425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3936 0.6425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5060 0.8326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5060 0.8326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9497 0.9635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9497 0.9635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9497 1.6057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9497 1.6057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3936 1.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3936 1.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5058 1.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5058 1.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5060 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5060 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3983 1.6365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3983 1.6365 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 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 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 |
| − | 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 |
| − | 20 15 1 0 0 0 0 | + | 20 15 1 0 0 0 0 |
| − | 19 21 1 0 0 0 0 | + | 19 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 |
| − | 1 25 1 0 0 0 0 | + | 1 25 1 0 0 0 0 |
| − | 16 26 1 0 0 0 0 | + | 16 26 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FACNI0001 | + | ID FL3FACNI0001 |
| − | KNApSAcK_ID C00004034 | + | KNApSAcK_ID C00004034 |
| − | NAME 5,7,3',4'-Tetrahydroxy-8-prenylflavone | + | NAME 5,7,3',4'-Tetrahydroxy-8-prenylflavone |
| − | CAS_RN 14926-12-6 | + | CAS_RN 14926-12-6 |
| − | FORMULA C20H18O6 | + | FORMULA C20H18O6 |
| − | EXACTMASS 354.110338308 | + | EXACTMASS 354.110338308 |
| − | AVERAGEMASS 354.35332 | + | AVERAGEMASS 354.35332 |
| − | SMILES C(=O)(C=2)c(c1OC2c(c3)cc(c(O)c3)O)c(cc(O)c(CC=C(C)C)1)O | + | SMILES C(=O)(C=2)c(c1OC2c(c3)cc(c(O)c3)O)c(cc(O)c(CC=C(C)C)1)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/
26 28 0 0 0 0 0 0 0 0999 V2000
-1.9499 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9499 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3936 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8373 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8373 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3936 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2810 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2753 -0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2753 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2810 0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2810 -1.7854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8314 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3983 -0.3273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9653 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9653 0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3983 0.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8314 0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3936 -1.9267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3936 0.6425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5060 0.8326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9497 0.9635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9497 1.6057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3936 1.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5058 1.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5060 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3983 1.6365 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
7 11 2 0 0 0 0
9 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
3 18 1 0 0 0 0
6 19 1 0 0 0 0
20 15 1 0 0 0 0
19 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
1 25 1 0 0 0 0
16 26 1 0 0 0 0
S SKP 8
ID FL3FACNI0001
KNApSAcK_ID C00004034
NAME 5,7,3',4'-Tetrahydroxy-8-prenylflavone
CAS_RN 14926-12-6
FORMULA C20H18O6
EXACTMASS 354.110338308
AVERAGEMASS 354.35332
SMILES C(=O)(C=2)c(c1OC2c(c3)cc(c(O)c3)O)c(cc(O)c(CC=C(C)C)1)O
M END
