Mol:FL2FACNP0003
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 27 30 0 0 0 0 0 0 0 0999 V2000 | + | 27 30 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.3832 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3832 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8623 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8623 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3414 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3414 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3414 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3414 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8623 0.1313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8623 0.1313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3832 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3832 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8205 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8205 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2996 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2996 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2996 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2996 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8205 0.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8205 0.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2207 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2207 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8205 -1.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8205 -1.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7551 -0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7551 -0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2895 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2895 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2895 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2895 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7551 1.0565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7551 1.0565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2207 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2207 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9040 0.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9040 0.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8623 -1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8623 -1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8229 -0.1770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8229 -0.1770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3564 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3564 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8887 -0.1763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8887 -0.1763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8229 1.0560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8229 1.0560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7551 1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7551 1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3582 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3582 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9040 0.4329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9040 0.4329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8563 1.2461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8563 1.2461 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 |
| − | 6 18 1 0 0 0 0 | + | 6 18 1 0 0 0 0 |
| − | 2 19 1 0 0 0 0 | + | 2 19 1 0 0 0 0 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 15 23 1 0 0 0 0 | + | 15 23 1 0 0 0 0 |
| − | 16 24 1 0 0 0 0 | + | 16 24 1 0 0 0 0 |
| − | 21 25 1 0 0 0 0 | + | 21 25 1 0 0 0 0 |
| − | 25 23 1 0 0 0 0 | + | 25 23 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 25 27 1 0 0 0 0 | + | 25 27 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FACNP0003 | + | ID FL2FACNP0003 |
| − | KNApSAcK_ID C00008457 | + | KNApSAcK_ID C00008457 |
| − | NAME Sigmoidin D | + | NAME Sigmoidin D |
| − | CAS_RN 106533-44-2 | + | CAS_RN 106533-44-2 |
| − | FORMULA C20H20O7 | + | FORMULA C20H20O7 |
| − | EXACTMASS 372.120902994 | + | EXACTMASS 372.120902994 |
| − | AVERAGEMASS 372.3686 | + | AVERAGEMASS 372.3686 |
| − | SMILES c(c(O)4)c(O)c(c(c4)1)C(=O)CC(c(c3)cc(c2c(O)3)CC(C(C)(C)O2)O)O1 | + | SMILES c(c(O)4)c(O)c(c(c4)1)C(=O)CC(c(c3)cc(c2c(O)3)CC(C(C)(C)O2)O)O1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
27 30 0 0 0 0 0 0 0 0999 V2000
-2.3832 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8623 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3414 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3414 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8623 0.1313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3832 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8205 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2996 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2996 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8205 0.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2207 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8205 -1.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7551 -0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2895 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2895 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7551 1.0565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2207 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9040 0.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8623 -1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8229 -0.1770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3564 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8887 -0.1763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8229 1.0560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7551 1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3582 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9040 0.4329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8563 1.2461 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
6 18 1 0 0 0 0
2 19 1 0 0 0 0
14 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
15 23 1 0 0 0 0
16 24 1 0 0 0 0
21 25 1 0 0 0 0
25 23 1 0 0 0 0
25 26 1 0 0 0 0
25 27 1 0 0 0 0
S SKP 8
ID FL2FACNP0003
KNApSAcK_ID C00008457
NAME Sigmoidin D
CAS_RN 106533-44-2
FORMULA C20H20O7
EXACTMASS 372.120902994
AVERAGEMASS 372.3686
SMILES c(c(O)4)c(O)c(c(c4)1)C(=O)CC(c(c3)cc(c2c(O)3)CC(C(C)(C)O2)O)O1
M END
