Mol:FL3F9GNS0003
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 23 25 0 0 0 0 0 0 0 0999 V2000 | + | 23 25 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.7906 -1.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7906 -1.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7906 -0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7906 -0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5198 0.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5198 0.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2490 -0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2490 -0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2490 -1.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2490 -1.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5198 -1.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5198 -1.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0613 -1.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0613 -1.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3321 -1.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3321 -1.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3321 -0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3321 -0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0613 0.0175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0613 0.0175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3824 0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3824 0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1012 -0.4061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1012 -0.4061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8201 0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8201 0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8201 0.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8201 0.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1012 1.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1012 1.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3824 0.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3824 0.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0613 -2.4916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0613 -2.4916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5346 1.2516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5346 1.2516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2490 0.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2490 0.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5346 -0.4035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5346 -0.4035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2490 0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2490 0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1012 2.0791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1012 2.0791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8157 2.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8157 2.4916 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 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 13 20 1 0 0 0 0 | + | 13 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 15 22 1 0 0 0 0 | + | 15 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3F9GNS0003 | + | ID FL3F9GNS0003 |
| − | KNApSAcK_ID C00013299 | + | KNApSAcK_ID C00013299 |
| − | NAME 3',4',5'-Trimethoxyflavone;2-(3,4,5-Trimethoxyphenyl)-4H-1-benzopyran-4-one | + | NAME 3',4',5'-Trimethoxyflavone;2-(3,4,5-Trimethoxyphenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 67858-30-4 | + | CAS_RN 67858-30-4 |
| − | FORMULA C18H16O5 | + | FORMULA C18H16O5 |
| − | EXACTMASS 312.099773622 | + | EXACTMASS 312.099773622 |
| − | AVERAGEMASS 312.31664 | + | AVERAGEMASS 312.31664 |
| − | SMILES c(c1OC)(OC)cc(C(=C3)Oc(c2C(=O)3)cccc2)cc1OC | + | SMILES c(c1OC)(OC)cc(C(=C3)Oc(c2C(=O)3)cccc2)cc1OC |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
23 25 0 0 0 0 0 0 0 0999 V2000
-1.7906 -1.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7906 -0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5198 0.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2490 -0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2490 -1.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5198 -1.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0613 -1.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3321 -1.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3321 -0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0613 0.0175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3824 0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1012 -0.4061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8201 0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8201 0.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1012 1.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3824 0.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0613 -2.4916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5346 1.2516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2490 0.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5346 -0.4035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2490 0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1012 2.0791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8157 2.4916 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
14 18 1 0 0 0 0
18 19 1 0 0 0 0
13 20 1 0 0 0 0
20 21 1 0 0 0 0
15 22 1 0 0 0 0
22 23 1 0 0 0 0
S SKP 8
ID FL3F9GNS0003
KNApSAcK_ID C00013299
NAME 3',4',5'-Trimethoxyflavone;2-(3,4,5-Trimethoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 67858-30-4
FORMULA C18H16O5
EXACTMASS 312.099773622
AVERAGEMASS 312.31664
SMILES c(c1OC)(OC)cc(C(=C3)Oc(c2C(=O)3)cccc2)cc1OC
M END
