Mol:FL5FE8NS0002
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 28 0 0 0 0 0 0 0 0999 V2000 | + | 26 28 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.7138 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7138 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7138 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7138 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4283 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4283 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1428 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1428 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1427 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1427 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4283 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4283 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0007 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0007 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7152 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7152 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7151 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7151 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0007 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0007 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4295 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4295 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1440 0.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1440 0.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8584 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8584 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8584 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8584 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1439 1.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1439 1.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4294 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4294 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0007 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0007 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8572 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8572 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4296 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4296 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5705 0.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5705 0.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8572 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8572 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5717 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5717 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4283 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4283 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1440 -0.6172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1440 -0.6172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5717 0.2071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5717 0.2071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4296 -1.7609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4296 -1.7609 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 |
| − | 1 7 1 0 0 0 0 | + | 1 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 2 1 0 0 0 0 | + | 10 2 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 11 12 2 0 0 0 0 | + | 11 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 11 1 0 0 0 0 | + | 16 11 1 0 0 0 0 |
| − | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
| − | 4 18 1 0 0 0 0 | + | 4 18 1 0 0 0 0 |
| − | 8 19 1 0 0 0 0 | + | 8 19 1 0 0 0 0 |
| − | 18 20 1 0 0 0 0 | + | 18 20 1 0 0 0 0 |
| − | 5 21 1 0 0 0 0 | + | 5 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 6 23 1 0 0 0 0 | + | 6 23 1 0 0 0 0 |
| − | 12 24 1 0 0 0 0 | + | 12 24 1 0 0 0 0 |
| − | 13 25 1 0 0 0 0 | + | 13 25 1 0 0 0 0 |
| − | 19 26 1 0 0 0 0 | + | 19 26 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FE8NS0002 | + | ID FL5FE8NS0002 |
| − | KNApSAcK_ID C00013366 | + | KNApSAcK_ID C00013366 |
| − | NAME 5,2',3'-Trihydroxy-3,6,7-trimethoxyflavone | + | NAME 5,2',3'-Trihydroxy-3,6,7-trimethoxyflavone |
| − | CAS_RN - | + | CAS_RN - |
| − | FORMULA C18H16O8 | + | FORMULA C18H16O8 |
| − | EXACTMASS 360.08451748799996 | + | EXACTMASS 360.08451748799996 |
| − | AVERAGEMASS 360.31484 | + | AVERAGEMASS 360.31484 |
| − | SMILES c(c3OC)c(O1)c(c(c3OC)O)C(C(=C1c(c(O)2)cccc2O)OC)=O | + | SMILES c(c3OC)c(O1)c(c(c3OC)O)C(C(=C1c(c(O)2)cccc2O)OC)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
26 28 0 0 0 0 0 0 0 0999 V2000
-0.7138 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7138 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4283 0.6186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1428 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1427 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4283 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0007 -1.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7152 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7151 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0007 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4295 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1440 0.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8584 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8584 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1439 1.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4294 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0007 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8572 0.6186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4296 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5705 0.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8572 -1.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5717 -0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4283 -1.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1440 -0.6172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5717 0.2071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4296 -1.7609 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
1 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 2 1 0 0 0 0
9 11 1 0 0 0 0
11 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 11 1 0 0 0 0
7 17 2 0 0 0 0
4 18 1 0 0 0 0
8 19 1 0 0 0 0
18 20 1 0 0 0 0
5 21 1 0 0 0 0
21 22 1 0 0 0 0
6 23 1 0 0 0 0
12 24 1 0 0 0 0
13 25 1 0 0 0 0
19 26 1 0 0 0 0
S SKP 8
ID FL5FE8NS0002
KNApSAcK_ID C00013366
NAME 5,2',3'-Trihydroxy-3,6,7-trimethoxyflavone
CAS_RN -
FORMULA C18H16O8
EXACTMASS 360.08451748799996
AVERAGEMASS 360.31484
SMILES c(c3OC)c(O1)c(c(c3OC)O)C(C(=C1c(c(O)2)cccc2O)OC)=O
M END
