Mol:FL2FAANI0007
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 30 32 0 0 0 0 0 0 0 0999 V2000 | + | 30 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.9630 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9630 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9630 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9630 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4067 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4067 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8504 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8504 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8504 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8504 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4067 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4067 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2941 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2941 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2622 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2622 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2622 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2622 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2941 -0.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2941 -0.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8183 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8183 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3853 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3853 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9523 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9523 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9523 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9523 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3853 0.4737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3853 0.4737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8183 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8183 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2941 -2.3368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2941 -2.3368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4067 -2.4351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4067 -2.4351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5191 -0.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5191 -0.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5191 0.4736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5191 0.4736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4067 0.1339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4067 0.1339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9628 0.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9628 0.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9628 1.0971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9628 1.0971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5189 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5189 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4067 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4067 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3853 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3853 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9521 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9521 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 1.3865 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3865 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5177 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5177 2.4351 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 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 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 |
| − | 15 26 1 0 0 0 0 | + | 15 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 2 0 0 0 0 | + | 27 28 2 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 28 30 1 0 0 0 0 | + | 28 30 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FAANI0007 | + | ID FL2FAANI0007 |
| − | KNApSAcK_ID C00008266 | + | KNApSAcK_ID C00008266 |
| − | NAME Euchrestaflavanone A | + | NAME Euchrestaflavanone A |
| − | CAS_RN 80510-05-0 | + | CAS_RN 80510-05-0 |
| − | FORMULA C25H28O5 | + | FORMULA C25H28O5 |
| − | EXACTMASS 408.193674006 | + | EXACTMASS 408.193674006 |
| − | AVERAGEMASS 408.48682 | + | AVERAGEMASS 408.48682 |
| − | SMILES C(=CCc(c1O)cc(C(O3)CC(=O)c(c32)c(cc(O)c2CC=C(C)C)O)cc1)(C)C | + | SMILES C(=CCc(c1O)cc(C(O3)CC(=O)c(c32)c(cc(O)c2CC=C(C)C)O)cc1)(C)C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
30 32 0 0 0 0 0 0 0 0999 V2000
-1.9630 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9630 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4067 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8504 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8504 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4067 -0.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2941 -1.7930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2622 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2622 -0.8294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2941 -0.5083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8183 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3853 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9523 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9523 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3853 0.4737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8183 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2941 -2.3368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4067 -2.4351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5191 -0.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5191 0.4736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4067 0.1339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9628 0.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9628 1.0971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5189 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4067 1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3853 1.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9521 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9521 2.1085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3865 2.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5177 2.4351 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
3 18 1 0 0 0 0
1 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
15 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 2 0 0 0 0
28 29 1 0 0 0 0
28 30 1 0 0 0 0
S SKP 8
ID FL2FAANI0007
KNApSAcK_ID C00008266
NAME Euchrestaflavanone A
CAS_RN 80510-05-0
FORMULA C25H28O5
EXACTMASS 408.193674006
AVERAGEMASS 408.48682
SMILES C(=CCc(c1O)cc(C(O3)CC(=O)c(c32)c(cc(O)c2CC=C(C)C)O)cc1)(C)C
M END
