Mol:FL1DA9NI0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 24 25 0 0 0 0 0 0 0 0999 V2000 | + | 24 25 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.0668 0.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0668 0.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0668 -0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0668 -0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6020 -0.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6020 -0.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1373 -0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1373 -0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1373 0.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1373 0.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6020 0.8048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6020 0.8048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6020 -0.8048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6020 -0.8048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3271 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3271 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7904 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7904 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2536 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2536 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7168 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7168 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1800 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1800 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6432 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6432 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6432 0.5340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6432 0.5340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1800 0.8014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1800 0.8014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7168 0.5340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7168 0.5340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3271 -0.8032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3271 -0.8032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4490 0.7571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4490 0.7571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5013 -0.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5013 -0.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8823 0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8823 0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2634 -0.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2634 -0.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6432 0.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6432 0.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2634 -0.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2634 -0.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3271 0.8046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3271 0.8046 0.0000 O 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 |
| − | 3 7 1 0 0 0 0 | + | 3 7 1 0 0 0 0 |
| − | 4 8 1 0 0 0 0 | + | 4 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 11 1 0 0 0 0 | + | 10 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 |
| − | 8 17 2 0 0 0 0 | + | 8 17 2 0 0 0 0 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 2 0 0 0 0 | + | 20 21 2 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 2 19 1 0 0 0 0 | + | 2 19 1 0 0 0 0 |
| − | 5 24 1 0 0 0 0 | + | 5 24 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL1DA9NI0001 | + | ID FL1DA9NI0001 |
| − | KNApSAcK_ID C00008003 | + | KNApSAcK_ID C00008003 |
| − | NAME 2',4',6'-Trihydroxy-3'-prenyldihydrochalcone | + | NAME 2',4',6'-Trihydroxy-3'-prenyldihydrochalcone |
| − | CAS_RN 96552-64-6 | + | CAS_RN 96552-64-6 |
| − | FORMULA C20H22O4 | + | FORMULA C20H22O4 |
| − | EXACTMASS 326.151809192 | + | EXACTMASS 326.151809192 |
| − | AVERAGEMASS 326.38628 | + | AVERAGEMASS 326.38628 |
| − | SMILES C(c(c1O)c(cc(c1C(=O)CCc(c2)cccc2)O)O)C=C(C)C | + | SMILES C(c(c1O)c(cc(c1C(=O)CCc(c2)cccc2)O)O)C=C(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/
24 25 0 0 0 0 0 0 0 0999 V2000
-1.0668 0.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0668 -0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6020 -0.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1373 -0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1373 0.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6020 0.8048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6020 -0.8048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3271 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7904 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2536 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7168 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1800 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6432 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6432 0.5340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1800 0.8014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7168 0.5340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3271 -0.8032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4490 0.7571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5013 -0.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8823 0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2634 -0.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6432 0.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2634 -0.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3271 0.8046 0.0000 O 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
3 7 1 0 0 0 0
4 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 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
8 17 2 0 0 0 0
1 18 1 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
2 19 1 0 0 0 0
5 24 1 0 0 0 0
S SKP 8
ID FL1DA9NI0001
KNApSAcK_ID C00008003
NAME 2',4',6'-Trihydroxy-3'-prenyldihydrochalcone
CAS_RN 96552-64-6
FORMULA C20H22O4
EXACTMASS 326.151809192
AVERAGEMASS 326.38628
SMILES C(c(c1O)c(cc(c1C(=O)CCc(c2)cccc2)O)O)C=C(C)C
M END
