Mol:FL3FALNP0007
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 34 0 0 0 0 0 0 0 0999 V2000 | + | 31 34 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.9555 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9555 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9555 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9555 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3992 -1.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3992 -1.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8429 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8429 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8429 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8429 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3992 -0.1286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3992 -0.1286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2866 -1.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2866 -1.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2697 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2697 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2697 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2697 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2866 -0.1286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2866 -0.1286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2866 -1.9141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2866 -1.9141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8258 -0.1287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8258 -0.1287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3928 -0.4560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3928 -0.4560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9597 -0.1287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9597 -0.1287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9597 0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9597 0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3928 0.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3928 0.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8258 0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8258 0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3992 -2.0554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3992 -2.0554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5116 -0.1287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5116 -0.1287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8258 -1.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8258 -1.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3819 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3819 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9340 -1.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9340 -1.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9286 -2.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9286 -2.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4917 -1.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4917 -1.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5116 0.8446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5116 0.8446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3928 1.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3928 1.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8258 1.8354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8258 1.8354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2588 1.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2588 1.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2588 0.8533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2588 0.8533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2705 1.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2705 1.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1115 2.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1115 2.0579 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 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 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 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 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 12 1 0 0 0 0 | + | 17 12 1 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 |
| − | 8 20 1 0 0 0 0 | + | 8 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 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 15 25 1 0 0 0 0 | + | 15 25 1 0 0 0 0 |
| − | 16 26 1 0 0 0 0 | + | 16 26 1 0 0 0 0 |
| − | 26 27 2 0 0 0 0 | + | 26 27 2 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 29 17 1 0 0 0 0 | + | 29 17 1 0 0 0 0 |
| − | 28 30 1 0 0 0 0 | + | 28 30 1 0 0 0 0 |
| − | 28 31 1 0 0 0 0 | + | 28 31 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FALNP0007 | + | ID FL3FALNP0007 |
| − | KNApSAcK_ID C00004057 | + | KNApSAcK_ID C00004057 |
| − | NAME Kuwanon A | + | NAME Kuwanon A |
| − | CAS_RN 62949-77-3 | + | CAS_RN 62949-77-3 |
| − | FORMULA C25H24O6 | + | FORMULA C25H24O6 |
| − | EXACTMASS 420.1572885 | + | EXACTMASS 420.1572885 |
| − | AVERAGEMASS 420.45446 | + | AVERAGEMASS 420.45446 |
| − | SMILES O(c12)C(c(c43)ccc(O)c3C=CC(C)(C)O4)=C(CC=C(C)C)C(=O)c(c(cc(O)c2)O)1 | + | SMILES O(c12)C(c(c43)ccc(O)c3C=CC(C)(C)O4)=C(CC=C(C)C)C(=O)c(c(cc(O)c2)O)1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
31 34 0 0 0 0 0 0 0 0999 V2000
-1.9555 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9555 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3992 -1.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8429 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8429 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3992 -0.1286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2866 -1.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2697 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2697 -0.4497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2866 -0.1286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2866 -1.9141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8258 -0.1287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3928 -0.4560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9597 -0.1287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9597 0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3928 0.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8258 0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3992 -2.0554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5116 -0.1287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8258 -1.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3819 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9340 -1.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9286 -2.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4917 -1.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5116 0.8446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3928 1.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8258 1.8354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2588 1.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2588 0.8533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2705 1.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1115 2.0579 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 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 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 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
3 18 1 0 0 0 0
1 19 1 0 0 0 0
8 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
22 24 1 0 0 0 0
15 25 1 0 0 0 0
16 26 1 0 0 0 0
26 27 2 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
29 17 1 0 0 0 0
28 30 1 0 0 0 0
28 31 1 0 0 0 0
S SKP 8
ID FL3FALNP0007
KNApSAcK_ID C00004057
NAME Kuwanon A
CAS_RN 62949-77-3
FORMULA C25H24O6
EXACTMASS 420.1572885
AVERAGEMASS 420.45446
SMILES O(c12)C(c(c43)ccc(O)c3C=CC(C)(C)O4)=C(CC=C(C)C)C(=O)c(c(cc(O)c2)O)1
M END
