Mol:FL2FACNI0011
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 31 33 0 0 0 0 0 0 0 0999 V2000 | + | 31 33 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.0451 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0451 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5242 -1.6245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5242 -1.6245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0033 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0033 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0033 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0033 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5242 -0.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5242 -0.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0451 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0451 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5176 -1.6245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5176 -1.6245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0385 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0385 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0385 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0385 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5176 -0.4216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5176 -0.4216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5588 -0.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5588 -0.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5176 -2.1484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5176 -2.1484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0932 -0.7304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0932 -0.7304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6275 -0.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6275 -0.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6275 0.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6275 0.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0932 0.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0932 0.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5588 0.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5588 0.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5242 -2.2254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5242 -2.2254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4719 -0.4759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4719 -0.4759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1610 0.5031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1610 0.5031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1610 -0.7299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1610 -0.7299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0932 1.1770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0932 1.1770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6515 1.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6515 1.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6515 2.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6515 2.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0022 2.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0022 2.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1326 2.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1326 2.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6148 -1.6527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6148 -1.6527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1774 -1.3279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1774 -1.3279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6815 -1.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6815 -1.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6815 -2.1910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6815 -2.1910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1610 -1.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1610 -1.3422 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 |
| − | 3 7 1 0 0 0 0 | + | 3 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 4 1 0 0 0 0 | + | 10 4 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 7 12 2 0 0 0 0 | + | 7 12 2 0 0 0 0 |
| − | 11 13 2 0 0 0 0 | + | 11 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 11 1 0 0 0 0 | + | 17 11 1 0 0 0 0 |
| − | 2 18 1 0 0 0 0 | + | 2 18 1 0 0 0 0 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 15 20 1 0 0 0 0 | + | 15 20 1 0 0 0 0 |
| − | 14 21 1 0 0 0 0 | + | 14 21 1 0 0 0 0 |
| − | 16 22 1 0 0 0 0 | + | 16 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 24 2 0 0 0 0 | + | 23 24 2 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
| − | 1 27 1 0 0 0 0 | + | 1 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 29 2 0 0 0 0 | + | 28 29 2 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 29 31 1 0 0 0 0 | + | 29 31 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FACNI0011 | + | ID FL2FACNI0011 |
| − | KNApSAcK_ID C00008544 | + | KNApSAcK_ID C00008544 |
| − | NAME 5,7,3',4'-Tetrahydroxy-6,5'-di-C-prenylflavanone | + | NAME 5,7,3',4'-Tetrahydroxy-6,5'-di-C-prenylflavanone |
| − | CAS_RN 156788-69-1 | + | CAS_RN 156788-69-1 |
| − | FORMULA C25H28O6 | + | FORMULA C25H28O6 |
| − | EXACTMASS 424.188588628 | + | EXACTMASS 424.188588628 |
| − | AVERAGEMASS 424.48622 | + | AVERAGEMASS 424.48622 |
| − | SMILES C(=C(C)C)Cc(c(O)1)cc(C(O2)CC(=O)c(c3O)c2cc(O)c3CC=C(C)C)cc1O | + | SMILES C(=C(C)C)Cc(c(O)1)cc(C(O2)CC(=O)c(c3O)c2cc(O)c3CC=C(C)C)cc1O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
31 33 0 0 0 0 0 0 0 0999 V2000
-1.0451 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5242 -1.6245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0033 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0033 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5242 -0.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0451 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5176 -1.6245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0385 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0385 -0.7223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5176 -0.4216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5588 -0.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5176 -2.1484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0932 -0.7304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6275 -0.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6275 0.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0932 0.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5588 0.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5242 -2.2254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4719 -0.4759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1610 0.5031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1610 -0.7299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0932 1.1770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6515 1.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6515 2.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0022 2.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1326 2.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6148 -1.6527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1774 -1.3279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6815 -1.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6815 -2.1910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1610 -1.3422 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
3 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 4 1 0 0 0 0
9 11 1 0 0 0 0
7 12 2 0 0 0 0
11 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 11 1 0 0 0 0
2 18 1 0 0 0 0
6 19 1 0 0 0 0
15 20 1 0 0 0 0
14 21 1 0 0 0 0
16 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
1 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 2 0 0 0 0
29 30 1 0 0 0 0
29 31 1 0 0 0 0
S SKP 8
ID FL2FACNI0011
KNApSAcK_ID C00008544
NAME 5,7,3',4'-Tetrahydroxy-6,5'-di-C-prenylflavanone
CAS_RN 156788-69-1
FORMULA C25H28O6
EXACTMASS 424.188588628
AVERAGEMASS 424.48622
SMILES C(=C(C)C)Cc(c(O)1)cc(C(O2)CC(=O)c(c3O)c2cc(O)c3CC=C(C)C)cc1O
M END
