Mol:FL2FALNI0001
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 |
| − | -3.9355 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9355 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9355 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9355 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3792 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3792 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8229 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8229 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8229 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8229 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3792 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3792 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2666 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2666 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7103 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7103 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7103 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7103 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2666 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2666 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1542 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1542 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5872 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5872 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0203 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0203 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0203 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0203 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5872 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5872 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1542 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1542 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2666 -1.3560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2666 -1.3560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3792 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3792 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.4916 0.4723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4916 0.4723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5465 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5465 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7210 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7210 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5465 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5465 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1122 0.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1122 0.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6778 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6778 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2422 0.4710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2422 0.4710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6778 -0.5067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6778 -0.5067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8055 0.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8055 0.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3675 0.4703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3675 0.4703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9296 0.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9296 0.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4916 0.4703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4916 0.4703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9296 -0.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9296 -0.5032 0.0000 C 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 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 0 0 0 0 | + | 9 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 |
| − | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 16 21 1 0 0 0 0 | + | 16 21 1 0 0 0 0 |
| − | 13 22 1 0 0 0 0 | + | 13 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 |
| − | 25 27 1 0 0 0 0 | + | 25 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 FL2FALNI0001 | + | ID FL2FALNI0001 |
| − | KNApSAcK_ID C00008328 | + | KNApSAcK_ID C00008328 |
| − | NAME Kuwanon E | + | NAME Kuwanon E |
| − | CAS_RN 68401-05-8 | + | CAS_RN 68401-05-8 |
| − | FORMULA C25H28O6 | + | FORMULA C25H28O6 |
| − | EXACTMASS 424.188588628 | + | EXACTMASS 424.188588628 |
| − | AVERAGEMASS 424.48622 | + | AVERAGEMASS 424.48622 |
| − | SMILES c(c3CC=C(C)CCC=C(C)C)c(c(cc(O)3)O)C(O2)CC(c(c12)c(cc(c1)O)O)=O | + | SMILES c(c3CC=C(C)CCC=C(C)C)c(c(cc(O)3)O)C(O2)CC(c(c12)c(cc(c1)O)O)=O |
M END | M END | ||
| − | |||
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
-3.9355 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9355 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3792 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8229 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8229 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3792 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2666 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7103 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7103 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2666 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1542 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5872 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0203 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0203 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5872 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1542 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2666 -1.3560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3792 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4916 0.4723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5465 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7210 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5465 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1122 0.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6778 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2422 0.4710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6778 -0.5067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8055 0.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3675 0.4703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9296 0.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4916 0.4703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9296 -0.5032 0.0000 C 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 1 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
9 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
7 17 2 0 0 0 0
3 18 1 0 0 0 0
1 19 1 0 0 0 0
14 20 1 0 0 0 0
16 21 1 0 0 0 0
13 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
25 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 FL2FALNI0001
KNApSAcK_ID C00008328
NAME Kuwanon E
CAS_RN 68401-05-8
FORMULA C25H28O6
EXACTMASS 424.188588628
AVERAGEMASS 424.48622
SMILES c(c3CC=C(C)CCC=C(C)C)c(c(cc(O)3)O)C(O2)CC(c(c12)c(cc(c1)O)O)=O
M END
