Mol:FL2FAANI0005
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 25 27 0 0 0 0 0 0 0 0999 V2000 | + | 25 27 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.9452 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9452 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9452 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9452 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3889 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3889 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8326 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8326 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8326 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8326 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3889 0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3889 0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2763 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2763 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2800 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2800 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2800 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2800 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2763 0.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2763 0.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8361 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8361 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4030 -0.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4030 -0.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9700 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9700 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9700 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9700 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4030 0.9821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4030 0.9821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8361 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8361 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2763 -1.8283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2763 -1.8283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5368 0.0206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5368 0.0206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3889 -1.9266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3889 -1.9266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5368 0.9821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5368 0.9821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3889 0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3889 0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9450 0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9450 0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9450 1.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9450 1.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3889 1.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3889 1.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5011 1.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5011 1.9266 0.0000 C 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 1 0 0 0 0 | + | 8 9 1 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 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 11 12 2 0 0 0 0 | + | 11 12 2 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 2 0 0 0 0 | + | 13 14 2 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
| − | 16 11 1 0 0 0 0 | + | 16 11 1 0 0 0 0 |
| − | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
| − | 18 1 1 0 0 0 0 | + | 18 1 1 0 0 0 0 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 6 21 1 0 0 0 0 | + | 6 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 23 2 0 0 0 0 | + | 22 23 2 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FAANI0005 | + | ID FL2FAANI0005 |
| − | KNApSAcK_ID C00008245 | + | KNApSAcK_ID C00008245 |
| − | NAME Sophoraflavanone B | + | NAME Sophoraflavanone B |
| − | CAS_RN 72357-32-5 | + | CAS_RN 72357-32-5 |
| − | FORMULA C20H20O5 | + | FORMULA C20H20O5 |
| − | EXACTMASS 340.13107375 | + | EXACTMASS 340.13107375 |
| − | AVERAGEMASS 340.3698 | + | AVERAGEMASS 340.3698 |
| − | SMILES C(=O)(C2)c(c1OC2c(c3)ccc(O)c3)c(cc(O)c(CC=C(C)C)1)O | + | SMILES C(=O)(C2)c(c1OC2c(c3)ccc(O)c3)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/
25 27 0 0 0 0 0 0 0 0999 V2000
-1.9452 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9452 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3889 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8326 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8326 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3889 0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2763 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2800 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2800 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2763 0.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8361 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4030 -0.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9700 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9700 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4030 0.9821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8361 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2763 -1.8283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5368 0.0206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3889 -1.9266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5368 0.9821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3889 0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9450 0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9450 1.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3889 1.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5011 1.9266 0.0000 C 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 1 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
9 11 1 0 0 0 0
11 12 2 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 11 1 0 0 0 0
7 17 2 0 0 0 0
18 1 1 0 0 0 0
3 19 1 0 0 0 0
14 20 1 0 0 0 0
6 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 2 0 0 0 0
23 24 1 0 0 0 0
23 25 1 0 0 0 0
S SKP 8
ID FL2FAANI0005
KNApSAcK_ID C00008245
NAME Sophoraflavanone B
CAS_RN 72357-32-5
FORMULA C20H20O5
EXACTMASS 340.13107375
AVERAGEMASS 340.3698
SMILES C(=O)(C2)c(c1OC2c(c3)ccc(O)c3)c(cc(O)c(CC=C(C)C)1)O
M END
