Mol:FL4DA9NI0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 25 27 0 0 0 0 0 0 0 0999 V2000 | + | 25 27 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.7968 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7968 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2759 -0.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2759 -0.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2450 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2450 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2450 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2450 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2759 0.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2759 0.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7968 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7968 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7659 -0.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7659 -0.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2868 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2868 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2868 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2868 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7659 0.4393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7659 0.4393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8071 0.4390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8071 0.4390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7659 -1.2876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7659 -1.2876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3415 0.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3415 0.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8759 0.4390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8759 0.4390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8759 1.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8759 1.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3415 1.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3415 1.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8071 1.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8071 1.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3171 0.4390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3171 0.4390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3171 -0.7634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3171 -0.7634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8375 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8375 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3567 -0.7627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3567 -0.7627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8759 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8759 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3567 -1.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3567 -1.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8071 -0.7634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8071 -0.7634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2759 -1.3645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2759 -1.3645 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 |
| − | 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 6 0 0 0 | + | 9 11 1 6 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 |
| − | 6 18 1 0 0 0 0 | + | 6 18 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 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 |
| − | 8 24 1 1 0 0 0 | + | 8 24 1 1 0 0 0 |
| − | 2 25 1 0 0 0 0 | + | 2 25 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL4DA9NI0001 | + | ID FL4DA9NI0001 |
| − | KNApSAcK_ID C00008607 | + | KNApSAcK_ID C00008607 |
| − | NAME Glepidotin B | + | NAME Glepidotin B |
| − | CAS_RN 87440-56-0 | + | CAS_RN 87440-56-0 |
| − | FORMULA C20H20O5 | + | FORMULA C20H20O5 |
| − | EXACTMASS 340.13107375 | + | EXACTMASS 340.13107375 |
| − | AVERAGEMASS 340.3698 | + | AVERAGEMASS 340.3698 |
| − | SMILES C(c(c3O)c(O)cc(c32)OC(C(C2=O)O)c(c1)cccc1)C=C(C)C | + | SMILES C(c(c3O)c(O)cc(c32)OC(C(C2=O)O)c(c1)cccc1)C=C(C)C |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
25 27 0 0 0 0 0 0 0 0999 V2000
-0.7968 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2759 -0.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2450 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2450 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2759 0.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7968 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7659 -0.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2868 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2868 0.1385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7659 0.4393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8071 0.4390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7659 -1.2876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3415 0.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8759 0.4390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8759 1.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3415 1.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8071 1.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3171 0.4390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3171 -0.7634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8375 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3567 -0.7627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8759 -0.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3567 -1.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8071 -0.7634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2759 -1.3645 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
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 6 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
6 18 1 0 0 0 0
1 19 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
8 24 1 1 0 0 0
2 25 1 0 0 0 0
S SKP 8
ID FL4DA9NI0001
KNApSAcK_ID C00008607
NAME Glepidotin B
CAS_RN 87440-56-0
FORMULA C20H20O5
EXACTMASS 340.13107375
AVERAGEMASS 340.3698
SMILES C(c(c3O)c(O)cc(c32)OC(C(C2=O)O)c(c1)cccc1)C=C(C)C
M END
