Mol:FL3FALNP0004
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 26 29 0 0 0 0 0 0 0 0999 V2000 | + | 26 29 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.3800 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3800 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3800 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3800 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8237 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8237 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2674 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2674 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2674 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2674 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8237 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8237 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2889 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2889 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8452 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8452 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8452 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8452 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2889 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2889 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2889 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2889 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4013 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4013 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9683 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9683 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5352 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5352 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5352 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5352 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9683 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9683 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4013 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4013 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0487 1.3618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0487 1.3618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8237 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8237 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9363 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9363 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4926 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4926 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4926 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4926 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9363 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9363 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0487 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0487 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4926 0.7934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4926 0.7934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8345 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8345 1.4543 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 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 |
| − | 18 15 1 0 0 0 0 | + | 18 15 1 0 0 0 0 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 1 20 1 0 0 0 0 | + | 1 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 |
| − | 22 23 2 0 0 0 0 | + | 22 23 2 0 0 0 0 |
| − | 23 2 1 0 0 0 0 | + | 23 2 1 0 0 0 0 |
| − | 21 24 1 0 0 0 0 | + | 21 24 1 0 0 0 0 |
| − | 21 25 1 0 0 0 0 | + | 21 25 1 0 0 0 0 |
| − | 17 26 1 0 0 0 0 | + | 17 26 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FALNP0004 | + | ID FL3FALNP0004 |
| − | KNApSAcK_ID C00004053 | + | KNApSAcK_ID C00004053 |
| − | NAME Cycloartocarpesin;8-(2,4-Dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-6-one | + | NAME Cycloartocarpesin;8-(2,4-Dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-6-one |
| − | CAS_RN 23806-61-3 | + | CAS_RN 23806-61-3 |
| − | FORMULA C20H16O6 | + | FORMULA C20H16O6 |
| − | EXACTMASS 352.094688244 | + | EXACTMASS 352.094688244 |
| − | AVERAGEMASS 352.33744 | + | AVERAGEMASS 352.33744 |
| − | SMILES C(=O)(C=3)c(c2O)c(OC(c(c4)c(O)cc(O)c4)3)cc(c12)OC(C=C1)(C)C | + | SMILES C(=O)(C=3)c(c2O)c(OC(c(c4)c(O)cc(O)c4)3)cc(c12)OC(C=C1)(C)C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
26 29 0 0 0 0 0 0 0 0999 V2000
-1.3800 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3800 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8237 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2674 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2674 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8237 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2889 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8452 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8452 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2889 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2889 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4013 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9683 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5352 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5352 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9683 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4013 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0487 1.3618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8237 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9363 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4926 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4926 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9363 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0487 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4926 0.7934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8345 1.4543 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 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
18 15 1 0 0 0 0
3 19 1 0 0 0 0
1 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 2 0 0 0 0
23 2 1 0 0 0 0
21 24 1 0 0 0 0
21 25 1 0 0 0 0
17 26 1 0 0 0 0
S SKP 8
ID FL3FALNP0004
KNApSAcK_ID C00004053
NAME Cycloartocarpesin;8-(2,4-Dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-6-one
CAS_RN 23806-61-3
FORMULA C20H16O6
EXACTMASS 352.094688244
AVERAGEMASS 352.33744
SMILES C(=O)(C=3)c(c2O)c(OC(c(c4)c(O)cc(O)c4)3)cc(c12)OC(C=C1)(C)C
M END
