Mol:FL2FA9NR0004
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 36 39 0 0 0 0 0 0 0 0999 V2000 | + | 36 39 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.2178 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2178 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3031 -1.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3031 -1.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8240 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8240 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8240 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8240 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3031 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3031 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2178 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2178 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3448 -1.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3448 -1.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8657 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8657 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8657 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8657 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3448 0.0254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3448 0.0254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3861 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3861 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3448 -1.7014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3448 -1.7014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9205 -0.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9205 -0.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4548 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4548 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4548 0.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4548 0.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9205 0.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9205 0.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3861 0.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3861 0.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3031 -1.6419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3031 -1.6419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7382 0.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7382 0.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7382 -1.1772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7382 -1.1772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2585 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2585 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8077 -0.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8077 -0.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3569 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3569 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3569 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3569 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8077 -1.8280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8077 -1.8280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2585 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2585 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8077 0.0741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8077 0.0741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9059 -0.5599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9059 -0.5599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9059 -1.8279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9059 -1.8279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4548 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4548 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8029 -1.7740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8029 -1.7740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3031 0.6263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3031 0.6263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2173 0.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2173 0.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2173 1.5276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2173 1.5276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7377 1.8280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7377 1.8280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3031 1.8280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3031 1.8280 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 |
| − | 1 20 1 0 0 0 0 | + | 1 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 |
| − | 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 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 21 1 0 0 0 0 | + | 26 21 1 0 0 0 0 |
| − | 22 27 1 0 0 0 0 | + | 22 27 1 0 0 0 0 |
| − | 23 28 1 0 0 0 0 | + | 23 28 1 0 0 0 0 |
| − | 24 29 1 0 0 0 0 | + | 24 29 1 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 26 31 2 0 0 0 0 | + | 26 31 2 0 0 0 0 |
| − | 5 32 1 0 0 0 0 | + | 5 32 1 0 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | 33 34 2 0 0 0 0 | + | 33 34 2 0 0 0 0 |
| − | 34 35 1 0 0 0 0 | + | 34 35 1 0 0 0 0 |
| − | 34 36 1 0 0 0 0 | + | 34 36 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FA9NR0004 | + | ID FL2FA9NR0004 |
| − | KNApSAcK_ID C00008406 | + | KNApSAcK_ID C00008406 |
| − | NAME 8-Prenyllepidissipyrone | + | NAME 8-Prenyllepidissipyrone |
| − | CAS_RN 122616-68-6 | + | CAS_RN 122616-68-6 |
| − | FORMULA C29H30O7 | + | FORMULA C29H30O7 |
| − | EXACTMASS 490.199153314 | + | EXACTMASS 490.199153314 |
| − | AVERAGEMASS 490.5443 | + | AVERAGEMASS 490.5443 |
| − | SMILES CC(C)=CCc(c21)c(c(CC(=C4O)C(=O)OC(CC)=C4C)c(O)c1C(=O)CC(c(c3)cccc3)O2)O | + | SMILES CC(C)=CCc(c21)c(c(CC(=C4O)C(=O)OC(CC)=C4C)c(O)c1C(=O)CC(c(c3)cccc3)O2)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/
36 39 0 0 0 0 0 0 0 0999 V2000
-0.2178 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3031 -1.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8240 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8240 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3031 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2178 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3448 -1.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8657 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8657 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3448 0.0254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3861 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3448 -1.7014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9205 -0.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4548 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4548 0.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9205 0.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3861 0.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3031 -1.6419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7382 0.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7382 -1.1772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2585 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8077 -0.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3569 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3569 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8077 -1.8280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2585 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8077 0.0741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9059 -0.5599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9059 -1.8279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4548 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8029 -1.7740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3031 0.6263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2173 0.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2173 1.5276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7377 1.8280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3031 1.8280 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
1 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
23 24 2 0 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 21 1 0 0 0 0
22 27 1 0 0 0 0
23 28 1 0 0 0 0
24 29 1 0 0 0 0
29 30 1 0 0 0 0
26 31 2 0 0 0 0
5 32 1 0 0 0 0
32 33 1 0 0 0 0
33 34 2 0 0 0 0
34 35 1 0 0 0 0
34 36 1 0 0 0 0
S SKP 8
ID FL2FA9NR0004
KNApSAcK_ID C00008406
NAME 8-Prenyllepidissipyrone
CAS_RN 122616-68-6
FORMULA C29H30O7
EXACTMASS 490.199153314
AVERAGEMASS 490.5443
SMILES CC(C)=CCc(c21)c(c(CC(=C4O)C(=O)OC(CC)=C4C)c(O)c1C(=O)CC(c(c3)cccc3)O2)O
M END
