Mol:FL2F1ANI0012
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 25 27 0 0 0 0 0 0 0 0999 V2000 | + | 25 27 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.1918 -0.4158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1918 -0.4158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1895 -1.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1895 -1.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4725 -1.6501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4725 -1.6501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7609 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7609 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7610 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7610 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4764 -0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4764 -0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0428 -1.6499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0428 -1.6499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6680 -1.2373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6680 -1.2373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6662 -0.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6662 -0.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0466 0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0466 0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3806 0.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3806 0.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0934 -0.4061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0934 -0.4061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8078 0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8078 0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8077 0.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8077 0.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0932 1.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0932 1.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3787 0.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3787 0.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0428 -2.4749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0428 -2.4749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9062 -0.0033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9062 -0.0033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1912 2.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1912 2.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1912 1.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1912 1.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4764 0.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4764 0.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9058 2.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9058 2.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4768 2.4748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4768 2.4748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5097 1.2369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5097 1.2369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5097 -0.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5097 -0.3518 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 6 0 0 0 | + | 9 11 1 6 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 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 6 21 1 0 0 0 0 | + | 6 21 1 0 0 0 0 |
| − | 19 20 2 0 0 0 0 | + | 19 20 2 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 |
| − | 19 23 1 0 0 0 0 | + | 19 23 1 0 0 0 0 |
| − | 14 24 1 0 0 0 0 | + | 14 24 1 0 0 0 0 |
| − | 18 25 1 0 0 0 0 | + | 18 25 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2F1ANI0012 | + | ID FL2F1ANI0012 |
| − | KNApSAcK_ID C00014155 | + | KNApSAcK_ID C00014155 |
| − | NAME 4'-Hydroxyisoderricin;Mundulea flavanone A;4'-Hydroxy-7-methoxy-8-prenylflavanone | + | NAME 4'-Hydroxyisoderricin;Mundulea flavanone A;4'-Hydroxy-7-methoxy-8-prenylflavanone |
| − | CAS_RN 126909-50-0 | + | CAS_RN 126909-50-0 |
| − | FORMULA C21H22O4 | + | FORMULA C21H22O4 |
| − | EXACTMASS 338.151809192 | + | EXACTMASS 338.151809192 |
| − | AVERAGEMASS 338.39698 | + | AVERAGEMASS 338.39698 |
| − | SMILES Oc(c1)ccc(C(C2)Oc(c(CC=C(C)C)3)c(ccc3OC)C(=O)2)c1 | + | SMILES Oc(c1)ccc(C(C2)Oc(c(CC=C(C)C)3)c(ccc3OC)C(=O)2)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/
25 27 0 0 0 0 0 0 0 0999 V2000
-2.1918 -0.4158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1895 -1.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4725 -1.6501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7609 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7610 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4764 -0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0428 -1.6499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6680 -1.2373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6662 -0.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0466 0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3806 0.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0934 -0.4061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8078 0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8077 0.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0932 1.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3787 0.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0428 -2.4749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9062 -0.0033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1912 2.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1912 1.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4764 0.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9058 2.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4768 2.4748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5097 1.2369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5097 -0.3518 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 6 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
1 18 1 0 0 0 0
6 21 1 0 0 0 0
19 20 2 0 0 0 0
20 21 1 0 0 0 0
19 22 1 0 0 0 0
19 23 1 0 0 0 0
14 24 1 0 0 0 0
18 25 1 0 0 0 0
S SKP 8
ID FL2F1ANI0012
KNApSAcK_ID C00014155
NAME 4'-Hydroxyisoderricin;Mundulea flavanone A;4'-Hydroxy-7-methoxy-8-prenylflavanone
CAS_RN 126909-50-0
FORMULA C21H22O4
EXACTMASS 338.151809192
AVERAGEMASS 338.39698
SMILES Oc(c1)ccc(C(C2)Oc(c(CC=C(C)C)3)c(ccc3OC)C(=O)2)c1
M END
