Mol:FL4DACNI0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 27 29 0 0 0 0 0 0 0 0999 V2000 | + | 27 29 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.8205 -0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8205 -0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2996 -1.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2996 -1.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2213 -0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2213 -0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2213 -0.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2213 -0.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2996 0.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2996 0.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8205 -0.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8205 -0.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7421 -1.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7421 -1.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2630 -0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2630 -0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2630 -0.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2630 -0.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7421 0.1304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7421 0.1304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7421 -1.5965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7421 -1.5965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2996 -1.6735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2996 -1.6735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3409 0.1301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3409 0.1301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8471 0.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8471 0.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3690 -0.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3690 -0.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8909 0.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8909 0.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8909 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8909 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3690 1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3690 1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8471 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8471 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4128 1.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4128 1.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3690 1.6735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3690 1.6735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7991 -1.3079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7991 -1.3079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8601 -0.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8601 -0.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3780 0.1294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3780 0.1294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8960 -0.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8960 -0.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4128 0.1287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4128 0.1287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8960 -0.7664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8960 -0.7664 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 |
| − | 3 7 1 0 0 0 0 | + | 3 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 4 1 0 0 0 0 | + | 10 4 1 0 0 0 0 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 2 12 1 0 0 0 0 | + | 2 12 1 0 0 0 0 |
| − | 6 13 1 0 0 0 0 | + | 6 13 1 0 0 0 0 |
| − | 9 14 1 6 0 0 0 | + | 9 14 1 6 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 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
| − | 18 19 2 0 0 0 0 | + | 18 19 2 0 0 0 0 |
| − | 19 14 1 0 0 0 0 | + | 19 14 1 0 0 0 0 |
| − | 17 20 1 0 0 0 0 | + | 17 20 1 0 0 0 0 |
| − | 21 18 1 0 0 0 0 | + | 21 18 1 0 0 0 0 |
| − | 8 22 1 1 0 0 0 | + | 8 22 1 1 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 |
| − | 24 25 2 0 0 0 0 | + | 24 25 2 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 25 27 1 0 0 0 0 | + | 25 27 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL4DACNI0001 | + | ID FL4DACNI0001 |
| − | KNApSAcK_ID C00008636 | + | KNApSAcK_ID C00008636 |
| − | NAME 7-O-Prenyltaxifolin | + | NAME 7-O-Prenyltaxifolin |
| − | CAS_RN 78876-51-4 | + | CAS_RN 78876-51-4 |
| − | FORMULA C20H20O7 | + | FORMULA C20H20O7 |
| − | EXACTMASS 372.120902994 | + | EXACTMASS 372.120902994 |
| − | AVERAGEMASS 372.3686 | + | AVERAGEMASS 372.3686 |
| − | SMILES c(O)(c(O)3)ccc(c3)C(C2O)Oc(c1)c(C2=O)c(cc1OCC=C(C)C)O | + | SMILES c(O)(c(O)3)ccc(c3)C(C2O)Oc(c1)c(C2=O)c(cc1OCC=C(C)C)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/
27 29 0 0 0 0 0 0 0 0999 V2000
-0.8205 -0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2996 -1.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2213 -0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2213 -0.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2996 0.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8205 -0.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7421 -1.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2630 -0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2630 -0.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7421 0.1304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7421 -1.5965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2996 -1.6735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3409 0.1301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8471 0.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3690 -0.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8909 0.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8909 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3690 1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8471 0.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4128 1.0708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3690 1.6735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7991 -1.3079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8601 -0.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3780 0.1294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8960 -0.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4128 0.1287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8960 -0.7664 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
3 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 4 1 0 0 0 0
7 11 2 0 0 0 0
2 12 1 0 0 0 0
6 13 1 0 0 0 0
9 14 1 6 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 18 1 0 0 0 0
18 19 2 0 0 0 0
19 14 1 0 0 0 0
17 20 1 0 0 0 0
21 18 1 0 0 0 0
8 22 1 1 0 0 0
13 23 1 0 0 0 0
23 24 1 0 0 0 0
24 25 2 0 0 0 0
25 26 1 0 0 0 0
25 27 1 0 0 0 0
S SKP 8
ID FL4DACNI0001
KNApSAcK_ID C00008636
NAME 7-O-Prenyltaxifolin
CAS_RN 78876-51-4
FORMULA C20H20O7
EXACTMASS 372.120902994
AVERAGEMASS 372.3686
SMILES c(O)(c(O)3)ccc(c3)C(C2O)Oc(c1)c(C2=O)c(cc1OCC=C(C)C)O
M END
