Mol:FL1C19NP0003
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 26 0 0 0 0 0 0 0 0999 V2000 | + | 24 26 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.3767 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3767 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3767 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3767 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8204 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8204 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2641 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2641 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2641 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2641 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8204 0.8602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8204 0.8602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2922 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2922 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8485 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8485 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4046 -0.4244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4046 -0.4244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9607 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9607 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5217 -0.4273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5217 -0.4273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0827 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0827 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0827 0.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0827 0.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5217 0.8683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5217 0.8683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9607 0.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9607 0.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2922 -0.9259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2922 -0.9259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8204 -1.0669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8204 -1.0669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9330 0.8602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9330 0.8602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4893 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4893 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4893 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4893 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9330 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9330 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7941 1.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7941 1.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0827 0.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0827 0.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0454 -0.4244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0454 -0.4244 0.0000 O 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 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 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 10 1 0 0 0 0 | + | 15 10 1 0 0 0 0 |
| − | 7 16 2 0 0 0 0 | + | 7 16 2 0 0 0 0 |
| − | 17 3 1 0 0 0 0 | + | 17 3 1 0 0 0 0 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 2 1 0 0 0 0 | + | 21 2 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 |
| − | 20 24 1 0 0 0 0 | + | 20 24 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL1C19NP0003 | + | ID FL1C19NP0003 |
| − | KNApSAcK_ID C00007051 | + | KNApSAcK_ID C00007051 |
| − | NAME Flemistrictin C | + | NAME Flemistrictin C |
| − | CAS_RN 61235-36-7 | + | CAS_RN 61235-36-7 |
| − | FORMULA C20H20O4 | + | FORMULA C20H20O4 |
| − | EXACTMASS 324.136159128 | + | EXACTMASS 324.136159128 |
| − | AVERAGEMASS 324.37039999999996 | + | AVERAGEMASS 324.37039999999996 |
| − | SMILES c(c(O)3)(ccc(c32)OC(C)(C)C(O)C2)C(=O)C=Cc(c1)cccc1 | + | SMILES c(c(O)3)(ccc(c32)OC(C)(C)C(O)C2)C(=O)C=Cc(c1)cccc1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
24 26 0 0 0 0 0 0 0 0999 V2000
-1.3767 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3767 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8204 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2641 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2641 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8204 0.8602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2922 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8485 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4046 -0.4244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9607 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5217 -0.4273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0827 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0827 0.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5217 0.8683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9607 0.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2922 -0.9259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8204 -1.0669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9330 0.8602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4893 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4893 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9330 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7941 1.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0827 0.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0454 -0.4244 0.0000 O 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 2 0 0 0 0
9 10 1 0 0 0 0
10 11 2 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 10 1 0 0 0 0
7 16 2 0 0 0 0
17 3 1 0 0 0 0
1 18 1 0 0 0 0
18 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
21 2 1 0 0 0 0
19 22 1 0 0 0 0
19 23 1 0 0 0 0
20 24 1 0 0 0 0
S SKP 8
ID FL1C19NP0003
KNApSAcK_ID C00007051
NAME Flemistrictin C
CAS_RN 61235-36-7
FORMULA C20H20O4
EXACTMASS 324.136159128
AVERAGEMASS 324.37039999999996
SMILES c(c(O)3)(ccc(c32)OC(C)(C)C(O)C2)C(=O)C=Cc(c1)cccc1
M END
