Mol:FLIAALNP0004
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 29 0 0 0 0 0 0 0 0999 V2000 | + | 26 29 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.7245 0.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7245 0.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7245 -0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7245 -0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1682 -0.7027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1682 -0.7027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6119 -0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6119 -0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6119 0.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6119 0.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1682 0.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1682 0.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0556 -0.7027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0556 -0.7027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5007 -0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5007 -0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5007 0.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5007 0.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0556 0.5820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0556 0.5820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0568 -0.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0568 -0.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0568 -1.3894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0568 -1.3894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6516 -1.7328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6516 -1.7328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2463 -1.3894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2463 -1.3894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2463 -0.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2463 -0.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6516 -0.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6516 -0.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0556 -1.3449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0556 -1.3449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1682 -1.3449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1682 -1.3449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8405 -1.7325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8405 -1.7325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4626 -1.7325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4626 -1.7325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2608 0.6114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2608 0.6114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1682 1.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1682 1.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7117 1.5233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7117 1.5233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2552 1.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2552 1.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5573 1.7328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5573 1.7328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8405 1.0527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8405 1.0527 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 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 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 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
| − | 12 20 1 0 0 0 0 | + | 12 20 1 0 0 0 0 |
| − | 1 21 1 0 0 0 0 | + | 1 21 1 0 0 0 0 |
| − | 6 22 1 0 0 0 0 | + | 6 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 |
| − | 24 21 1 0 0 0 0 | + | 24 21 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIAALNP0004 | + | ID FLIAALNP0004 |
| − | KNApSAcK_ID C00009499 | + | KNApSAcK_ID C00009499 |
| − | NAME Parvisoflavone A | + | NAME Parvisoflavone A |
| − | CAS_RN 50277-01-5 | + | CAS_RN 50277-01-5 |
| − | FORMULA C20H16O6 | + | FORMULA C20H16O6 |
| − | EXACTMASS 352.094688244 | + | EXACTMASS 352.094688244 |
| − | AVERAGEMASS 352.33744 | + | AVERAGEMASS 352.33744 |
| − | SMILES c(c13)(OC=C(c(c4)c(O)cc(O)c4)C3=O)c(C=2)c(OC(C2)(C)C)cc1O | + | SMILES c(c13)(OC=C(c(c4)c(O)cc(O)c4)C3=O)c(C=2)c(OC(C2)(C)C)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/
26 29 0 0 0 0 0 0 0 0999 V2000
-1.7245 0.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7245 -0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1682 -0.7027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6119 -0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6119 0.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1682 0.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0556 -0.7027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5007 -0.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5007 0.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0556 0.5820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0568 -0.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0568 -1.3894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6516 -1.7328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2463 -1.3894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2463 -0.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6516 -0.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0556 -1.3449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1682 -1.3449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8405 -1.7325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4626 -1.7325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2608 0.6114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1682 1.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7117 1.5233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2552 1.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5573 1.7328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8405 1.0527 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 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 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
3 18 1 0 0 0 0
14 19 1 0 0 0 0
12 20 1 0 0 0 0
1 21 1 0 0 0 0
6 22 1 0 0 0 0
22 23 2 0 0 0 0
23 24 1 0 0 0 0
24 21 1 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
S SKP 8
ID FLIAALNP0004
KNApSAcK_ID C00009499
NAME Parvisoflavone A
CAS_RN 50277-01-5
FORMULA C20H16O6
EXACTMASS 352.094688244
AVERAGEMASS 352.33744
SMILES c(c13)(OC=C(c(c4)c(O)cc(O)c4)C3=O)c(C=2)c(OC(C2)(C)C)cc1O
M END
