Mol:FL1C28NP0002
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 |
| − | 3.1196 0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1196 0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1196 -0.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1196 -0.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6759 -0.5513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6759 -0.5513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2322 -0.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2322 -0.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2322 0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2322 0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6759 0.7334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6759 0.7334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9864 -0.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9864 -0.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5427 -0.5307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5427 -0.5307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4303 -0.5306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4303 -0.5306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8694 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8694 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4303 -1.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4303 -1.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8694 0.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8694 0.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3167 0.7602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3167 0.7602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2359 0.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2359 0.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2359 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2359 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3167 -0.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3167 -0.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6759 1.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6759 1.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6759 -1.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6759 -1.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3167 1.1385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3167 1.1385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3167 -0.9243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3167 -0.9243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7885 0.7602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7885 0.7602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3412 0.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3412 0.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3412 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3412 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7885 -0.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7885 -0.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6765 0.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6765 0.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8760 0.1324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8760 0.1324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5030 0.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5030 0.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0845 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0845 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6724 0.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6724 0.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6724 1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6724 1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2322 0.1748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2322 0.1748 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 |
| − | 7 8 2 0 0 0 0 | + | 7 8 2 0 0 0 0 |
| − | 7 9 1 0 0 0 0 | + | 7 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 9 11 2 0 0 0 0 | + | 9 11 2 0 0 0 0 |
| − | 2 8 1 0 0 0 0 | + | 2 8 1 0 0 0 0 |
| − | 10 12 2 0 0 0 0 | + | 10 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 10 1 0 0 0 0 | + | 16 10 1 0 0 0 0 |
| − | 6 17 1 0 0 0 0 | + | 6 17 1 0 0 0 0 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 13 19 1 0 0 0 0 | + | 13 19 1 0 0 0 0 |
| − | 16 20 1 0 0 0 0 | + | 16 20 1 0 0 0 0 |
| − | 14 21 1 0 0 0 0 | + | 14 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 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 15 1 0 0 0 0 | + | 24 15 1 0 0 0 0 |
| − | 22 25 1 0 0 0 0 | + | 22 25 1 0 0 0 0 |
| − | 22 26 1 0 0 0 0 | + | 22 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 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 FL1C28NP0002 | + | ID FL1C28NP0002 |
| − | KNApSAcK_ID C00007152 | + | KNApSAcK_ID C00007152 |
| − | NAME Flemingin C | + | NAME Flemingin C |
| − | CAS_RN 18296-60-1 | + | CAS_RN 18296-60-1 |
| − | FORMULA C25H26O6 | + | FORMULA C25H26O6 |
| − | EXACTMASS 422.172938564 | + | EXACTMASS 422.172938564 |
| − | AVERAGEMASS 422.47033999999996 | + | AVERAGEMASS 422.47033999999996 |
| − | SMILES c(c3)(c(O)c(c(c3O)2)C=CC(CCC=C(C)C)(O2)C)C(=O)C=Cc(c(O)1)cc(cc1)O | + | SMILES c(c3)(c(O)c(c(c3O)2)C=CC(CCC=C(C)C)(O2)C)C(=O)C=Cc(c(O)1)cc(cc1)O |
M END | M END | ||
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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
3.1196 0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1196 -0.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6759 -0.5513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2322 -0.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2322 0.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6759 0.7334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9864 -0.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5427 -0.5307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4303 -0.5306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8694 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4303 -1.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8694 0.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3167 0.7602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2359 0.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2359 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3167 -0.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6759 1.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6759 -1.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3167 1.1385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3167 -0.9243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7885 0.7602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3412 0.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3412 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7885 -0.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6765 0.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8760 0.1324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5030 0.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0845 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6724 0.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6724 1.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2322 0.1748 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
7 8 2 0 0 0 0
7 9 1 0 0 0 0
9 10 1 0 0 0 0
9 11 2 0 0 0 0
2 8 1 0 0 0 0
10 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 10 1 0 0 0 0
6 17 1 0 0 0 0
3 18 1 0 0 0 0
13 19 1 0 0 0 0
16 20 1 0 0 0 0
14 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
24 15 1 0 0 0 0
22 25 1 0 0 0 0
22 26 1 0 0 0 0
26 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 FL1C28NP0002
KNApSAcK_ID C00007152
NAME Flemingin C
CAS_RN 18296-60-1
FORMULA C25H26O6
EXACTMASS 422.172938564
AVERAGEMASS 422.47033999999996
SMILES c(c3)(c(O)c(c(c3O)2)C=CC(CCC=C(C)C)(O2)C)C(=O)C=Cc(c(O)1)cc(cc1)O
M END
