Mol:FL5FACNP0001
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 28 31 0 0 0 0 0 0 0 0999 V2000 | + | 28 31 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.6848 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6848 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6848 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6848 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1285 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1285 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5722 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5722 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5722 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5722 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1285 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1285 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0159 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0159 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5404 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5404 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5404 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5404 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0159 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0159 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0159 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0159 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0965 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0965 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6634 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6634 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2304 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2304 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2304 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2304 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6634 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6634 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0965 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0965 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0965 -1.1394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0965 -1.1394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7972 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7972 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6634 1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6634 1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1285 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1285 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1285 0.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1285 0.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6848 1.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6848 1.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2411 0.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2411 0.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2411 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2411 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7972 1.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7972 1.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2411 1.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2411 1.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6818 1.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6818 1.2343 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 |
| − | 8 18 1 0 0 0 0 | + | 8 18 1 0 0 0 0 |
| − | 15 19 1 0 0 0 0 | + | 15 19 1 0 0 0 0 |
| − | 16 20 1 0 0 0 0 | + | 16 20 1 0 0 0 0 |
| − | 3 21 1 0 0 0 0 | + | 3 21 1 0 0 0 0 |
| − | 6 22 1 0 0 0 0 | + | 6 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 1 1 0 0 0 0 | + | 25 1 1 0 0 0 0 |
| − | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
| − | 24 27 1 0 0 0 0 | + | 24 27 1 0 0 0 0 |
| − | 22 28 1 4 0 0 0 | + | 22 28 1 4 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FACNP0001 | + | ID FL5FACNP0001 |
| − | KNApSAcK_ID C00005081 | + | KNApSAcK_ID C00005081 |
| − | NAME 4'',5''-Dihydro-3,5,3',4'-tetrahydroxy-4'',6'',6''-trimethylpyrano[2,3:7,8]flavone | + | NAME 4'',5''-Dihydro-3,5,3',4'-tetrahydroxy-4'',6'',6''-trimethylpyrano[2,3:7,8]flavone |
| − | CAS_RN 52617-83-1 | + | CAS_RN 52617-83-1 |
| − | FORMULA C21H20O7 | + | FORMULA C21H20O7 |
| − | EXACTMASS 384.120902994 | + | EXACTMASS 384.120902994 |
| − | AVERAGEMASS 384.37929999999994 | + | AVERAGEMASS 384.37929999999994 |
| − | SMILES C(C)(C)(C4)Oc(c(C(C)4)3)cc(c(c13)C(C(O)=C(c(c2)cc(c(O)c2)O)O1)=O)O | + | SMILES C(C)(C)(C4)Oc(c(C(C)4)3)cc(c(c13)C(C(O)=C(c(c2)cc(c(O)c2)O)O1)=O)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
28 31 0 0 0 0 0 0 0 0999 V2000
-1.6848 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6848 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1285 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5722 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5722 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1285 0.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0159 -1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5404 -0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5404 -0.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0159 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0159 -1.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0965 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6634 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2304 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2304 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6634 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0965 0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0965 -1.1394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7972 1.1270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6634 1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1285 -1.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1285 0.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6848 1.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2411 0.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2411 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7972 1.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2411 1.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6818 1.2343 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
8 18 1 0 0 0 0
15 19 1 0 0 0 0
16 20 1 0 0 0 0
3 21 1 0 0 0 0
6 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 1 1 0 0 0 0
24 26 1 0 0 0 0
24 27 1 0 0 0 0
22 28 1 4 0 0 0
S SKP 8
ID FL5FACNP0001
KNApSAcK_ID C00005081
NAME 4'',5''-Dihydro-3,5,3',4'-tetrahydroxy-4'',6'',6''-trimethylpyrano[2,3:7,8]flavone
CAS_RN 52617-83-1
FORMULA C21H20O7
EXACTMASS 384.120902994
AVERAGEMASS 384.37929999999994
SMILES C(C)(C)(C4)Oc(c(C(C)4)3)cc(c(c13)C(C(O)=C(c(c2)cc(c(O)c2)O)O1)=O)O
M END
