Mol:FL3FEANS0010
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 22 25 0 0 0 0 0 0 0 0999 V2000 | + | 22 25 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.7468 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7468 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7468 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7468 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1905 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1905 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6342 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6342 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6342 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6342 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1905 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1905 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0779 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0779 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4784 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4784 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4784 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4784 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0779 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0779 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0779 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0779 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0345 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0345 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6015 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6015 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1685 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1685 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1685 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1685 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6015 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6015 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0345 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0345 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1905 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1905 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3577 0.3498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3577 0.3498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7353 -0.1699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7353 -0.1699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3577 -0.6896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3577 -0.6896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7353 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7353 1.4543 0.0000 O 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 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 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 12 1 0 0 0 0 | + | 17 12 1 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 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 2 1 0 0 0 0 | + | 21 2 1 0 0 0 0 |
| − | 15 22 1 0 0 0 0 | + | 15 22 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FEANS0010 | + | ID FL3FEANS0010 |
| − | KNApSAcK_ID C00004001 | + | KNApSAcK_ID C00004001 |
| − | NAME Kanzakiflavone 2 | + | NAME Kanzakiflavone 2 |
| − | CAS_RN 60948-17-6 | + | CAS_RN 60948-17-6 |
| − | FORMULA C16H10O6 | + | FORMULA C16H10O6 |
| − | EXACTMASS 298.047738052 | + | EXACTMASS 298.047738052 |
| − | AVERAGEMASS 298.24699999999996 | + | AVERAGEMASS 298.24699999999996 |
| − | SMILES Oc(c4)ccc(c4)C(=C3)Oc(c1)c(C(=O)3)c(O)c(O2)c(OC2)1 | + | SMILES Oc(c4)ccc(c4)C(=C3)Oc(c1)c(C(=O)3)c(O)c(O2)c(OC2)1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
22 25 0 0 0 0 0 0 0 0999 V2000
-1.7468 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7468 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1905 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6342 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6342 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1905 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0779 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4784 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4784 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0779 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0779 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0345 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6015 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1685 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1685 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6015 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0345 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1905 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3577 0.3498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7353 -0.1699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3577 -0.6896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7353 1.4543 0.0000 O 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
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 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 12 1 0 0 0 0
3 18 1 0 0 0 0
1 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
21 2 1 0 0 0 0
15 22 1 0 0 0 0
S SKP 8
ID FL3FEANS0010
KNApSAcK_ID C00004001
NAME Kanzakiflavone 2
CAS_RN 60948-17-6
FORMULA C16H10O6
EXACTMASS 298.047738052
AVERAGEMASS 298.24699999999996
SMILES Oc(c4)ccc(c4)C(=C3)Oc(c1)c(C(=O)3)c(O)c(O2)c(OC2)1
M END
