Mol:FL2FEGNS0005
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 29 31 0 0 0 0 0 0 0 0999 V2000 | + | 29 31 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.5006 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2151 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2151 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2151 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2151 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9296 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9296 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9296 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9296 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9296 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9296 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 2.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 2.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 -2.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -2.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9296 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9296 0.2063 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 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 |
| − | 2 20 1 0 0 0 0 | + | 2 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 19 22 1 0 0 0 0 | + | 19 22 1 0 0 0 0 |
| − | 13 23 1 0 0 0 0 | + | 13 23 1 0 0 0 0 |
| − | 14 24 1 0 0 0 0 | + | 14 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 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 |
| − | 18 28 1 0 0 0 0 | + | 18 28 1 0 0 0 0 |
| − | 23 29 1 0 0 0 0 | + | 23 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FEGNS0005 | + | ID FL2FEGNS0005 |
| − | KNApSAcK_ID C00014141 | + | KNApSAcK_ID C00014141 |
| − | NAME 5,6,7,3',4',5'-Hexamethoxyflavanone | + | NAME 5,6,7,3',4',5'-Hexamethoxyflavanone |
| − | CAS_RN 74064-17-8 | + | CAS_RN 74064-17-8 |
| − | FORMULA C21H24O8 | + | FORMULA C21H24O8 |
| − | EXACTMASS 404.14711774399996 | + | EXACTMASS 404.14711774399996 |
| − | AVERAGEMASS 404.41046 | + | AVERAGEMASS 404.41046 |
| − | SMILES c(C(=O)1)(c3OC)c(cc(c3OC)OC)OC(c(c2)cc(OC)c(OC)c2OC)C1 | + | SMILES c(C(=O)1)(c3OC)c(cc(c3OC)OC)OC(c(c2)cc(OC)c(OC)c2OC)C1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
29 31 0 0 0 0 0 0 0 0999 V2000
-2.5006 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 -1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9296 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9296 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9296 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 2.2687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 2.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -2.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9296 0.2063 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 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
2 20 1 0 0 0 0
20 21 1 0 0 0 0
19 22 1 0 0 0 0
13 23 1 0 0 0 0
14 24 1 0 0 0 0
24 25 1 0 0 0 0
15 26 1 0 0 0 0
26 27 1 0 0 0 0
18 28 1 0 0 0 0
23 29 1 0 0 0 0
S SKP 8
ID FL2FEGNS0005
KNApSAcK_ID C00014141
NAME 5,6,7,3',4',5'-Hexamethoxyflavanone
CAS_RN 74064-17-8
FORMULA C21H24O8
EXACTMASS 404.14711774399996
AVERAGEMASS 404.41046
SMILES c(C(=O)1)(c3OC)c(cc(c3OC)OC)OC(c(c2)cc(OC)c(OC)c2OC)C1
M END
