Mol:FL2FA8NS0010
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 24 26 0 0 0 0 0 0 0 0999 V2000 | + | 24 26 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.4741 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4741 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4741 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4741 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7596 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7596 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0451 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0451 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0451 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0451 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7596 0.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7596 0.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3307 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3307 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3838 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3838 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3838 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3838 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3307 0.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3307 0.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1423 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1423 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8568 0.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8568 0.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5712 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5712 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5712 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5712 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8568 1.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8568 1.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1423 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1423 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3307 -1.8191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3307 -1.8191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1445 0.5315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1445 0.5315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7940 0.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7940 0.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7596 -1.8198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7596 -1.8198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8568 -0.4991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8568 -0.4991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3154 -0.8116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3154 -0.8116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1381 0.2551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1381 0.2551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7940 0.6337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7940 0.6337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 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 1 0 0 0 | + | 9 11 1 1 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 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
| − | 12 21 1 0 0 0 0 | + | 12 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 13 23 1 0 0 0 0 | + | 13 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FA8NS0010 | + | ID FL2FA8NS0010 |
| − | KNApSAcK_ID C00014129 | + | KNApSAcK_ID C00014129 |
| − | NAME (2R)-5-Hydroxy-7,2',3'-trimethoxyflavanone | + | NAME (2R)-5-Hydroxy-7,2',3'-trimethoxyflavanone |
| − | CAS_RN 652999-52-5 | + | CAS_RN 652999-52-5 |
| − | FORMULA C18H18O6 | + | FORMULA C18H18O6 |
| − | EXACTMASS 330.110338308 | + | EXACTMASS 330.110338308 |
| − | AVERAGEMASS 330.33191999999997 | + | AVERAGEMASS 330.33191999999997 |
| − | SMILES O(C(c(c(OC)3)cccc3OC)2)c(c1C(=O)C2)cc(OC)cc1O | + | SMILES O(C(c(c(OC)3)cccc3OC)2)c(c1C(=O)C2)cc(OC)cc1O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
24 26 0 0 0 0 0 0 0 0999 V2000
-2.4741 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4741 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7596 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0451 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0451 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7596 0.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3307 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3838 -0.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3838 0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3307 0.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1423 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8568 0.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5712 0.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5712 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8568 1.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1423 1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3307 -1.8191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1445 0.5315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7940 0.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7596 -1.8198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8568 -0.4991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3154 -0.8116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1381 0.2551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7940 0.6337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 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 1 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
1 18 1 0 0 0 0
18 19 1 0 0 0 0
3 20 1 0 0 0 0
12 21 1 0 0 0 0
21 22 1 0 0 0 0
13 23 1 0 0 0 0
23 24 1 0 0 0 0
S SKP 8
ID FL2FA8NS0010
KNApSAcK_ID C00014129
NAME (2R)-5-Hydroxy-7,2',3'-trimethoxyflavanone
CAS_RN 652999-52-5
FORMULA C18H18O6
EXACTMASS 330.110338308
AVERAGEMASS 330.33191999999997
SMILES O(C(c(c(OC)3)cccc3OC)2)c(c1C(=O)C2)cc(OC)cc1O
M END
