Mol:FL5FAANI0001
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 28 0 0 0 0 0 0 0 0999 V2000 | + | 26 28 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.1306 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1306 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1306 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1306 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5743 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5743 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0180 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0180 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0180 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0180 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5743 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5743 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5383 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5383 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0946 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0946 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0946 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0946 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5383 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5383 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5383 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5383 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6507 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6507 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2177 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2177 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7846 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7846 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7846 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7846 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2177 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2177 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6507 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6507 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6875 0.5019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6875 0.5019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6744 -0.7975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6744 -0.7975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6867 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6867 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2416 -0.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2416 -0.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7965 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7965 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7965 -1.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7965 -1.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3514 -0.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3514 -0.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5743 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5743 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3514 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3514 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 |
| − | 18 1 1 0 0 0 0 | + | 18 1 1 0 0 0 0 |
| − | 8 19 1 0 0 0 0 | + | 8 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 |
| − | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 3 25 1 0 0 0 0 | + | 3 25 1 0 0 0 0 |
| − | 15 26 1 0 0 0 0 | + | 15 26 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FAANI0001 | + | ID FL5FAANI0001 |
| − | KNApSAcK_ID C00004993 | + | KNApSAcK_ID C00004993 |
| − | NAME Licoflavonol;3,5,7-Trihydroxy-2-(4-hydroxyphenyl)-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one | + | NAME Licoflavonol;3,5,7-Trihydroxy-2-(4-hydroxyphenyl)-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 60197-60-6 | + | CAS_RN 60197-60-6 |
| − | FORMULA C20H18O6 | + | FORMULA C20H18O6 |
| − | EXACTMASS 354.110338308 | + | EXACTMASS 354.110338308 |
| − | AVERAGEMASS 354.35332 | + | AVERAGEMASS 354.35332 |
| − | SMILES c(c3)c(ccc(O)3)C(=C2O)Oc(c1C2=O)cc(c(CC=C(C)C)c1O)O | + | SMILES c(c3)c(ccc(O)3)C(=C2O)Oc(c1C2=O)cc(c(CC=C(C)C)c1O)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/
26 28 0 0 0 0 0 0 0 0999 V2000
-1.1306 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1306 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5743 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0180 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0180 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5743 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5383 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0946 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0946 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5383 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5383 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6507 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2177 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7846 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7846 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2177 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6507 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6875 0.5019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6744 -0.7975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6867 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2416 -0.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7965 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7965 -1.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3514 -0.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5743 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3514 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
18 1 1 0 0 0 0
8 19 1 0 0 0 0
2 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 2 0 0 0 0
22 23 1 0 0 0 0
22 24 1 0 0 0 0
3 25 1 0 0 0 0
15 26 1 0 0 0 0
S SKP 8
ID FL5FAANI0001
KNApSAcK_ID C00004993
NAME Licoflavonol;3,5,7-Trihydroxy-2-(4-hydroxyphenyl)-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one
CAS_RN 60197-60-6
FORMULA C20H18O6
EXACTMASS 354.110338308
AVERAGEMASS 354.35332
SMILES c(c3)c(ccc(O)3)C(=C2O)Oc(c1C2=O)cc(c(CC=C(C)C)c1O)O
M END
