Mol:FL3FA8GS0007
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 33 36 0 0 0 0 0 0 0 0999 V2000 | + | 33 36 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.8013 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8013 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8013 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8013 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0868 -0.2213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0868 -0.2213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3724 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3724 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3724 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3724 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0868 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0868 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3421 -0.2213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3421 -0.2213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0566 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0566 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0566 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0566 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3421 1.4287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3421 1.4287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7710 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7710 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4855 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4855 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2000 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2000 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2000 2.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2000 2.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4855 2.6662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4855 2.6662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7710 2.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7710 2.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3421 -1.0463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3421 -1.0463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5209 1.3632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5209 1.3632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4855 0.2561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4855 0.2561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0868 -1.0792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0868 -1.0792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1613 2.6058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1613 2.6058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6351 -2.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6351 -2.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4540 -1.9310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4540 -1.9310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5719 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5719 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0896 -0.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0896 -0.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2706 -0.5735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2706 -0.5735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1526 -1.3903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1526 -1.3903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5519 -1.3070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5519 -1.3070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1100 -1.6413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1100 -1.6413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8922 -2.6662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8922 -2.6662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0408 -2.2436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0408 -2.2436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0947 -1.5212 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0947 -1.5212 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2000 0.9712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2000 0.9712 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 |
| − | 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 |
| − | 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 |
| − | 18 1 1 0 0 0 0 | + | 18 1 1 0 0 0 0 |
| − | 12 19 1 0 0 0 0 | + | 12 19 1 0 0 0 0 |
| − | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
| − | 16 21 1 0 0 0 0 | + | 16 21 1 0 0 0 0 |
| − | 22 23 1 1 0 0 0 | + | 22 23 1 1 0 0 0 |
| − | 23 24 1 1 0 0 0 | + | 23 24 1 1 0 0 0 |
| − | 25 24 1 1 0 0 0 | + | 25 24 1 1 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 22 1 0 0 0 0 | + | 27 22 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 22 30 1 0 0 0 0 | + | 22 30 1 0 0 0 0 |
| − | 23 31 1 0 0 0 0 | + | 23 31 1 0 0 0 0 |
| − | 24 32 1 0 0 0 0 | + | 24 32 1 0 0 0 0 |
| − | 25 19 1 0 0 0 0 | + | 25 19 1 0 0 0 0 |
| − | 18 33 1 0 0 0 0 | + | 18 33 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FA8GS0007 | + | ID FL3FA8GS0007 |
| − | KNApSAcK_ID C00013652 | + | KNApSAcK_ID C00013652 |
| − | NAME 5,2',6'-Trihydroxy-7-methoxyflavone 2'-O-glucoside;2-[2-(beta-D-Glucopyranosyloxy)-6-hydroxyphenyl]-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one | + | NAME 5,2',6'-Trihydroxy-7-methoxyflavone 2'-O-glucoside;2-[2-(beta-D-Glucopyranosyloxy)-6-hydroxyphenyl]-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one |
| − | CAS_RN 223599-62-0 | + | CAS_RN 223599-62-0 |
| − | FORMULA C22H22O11 | + | FORMULA C22H22O11 |
| − | EXACTMASS 462.116211546 | + | EXACTMASS 462.116211546 |
| − | AVERAGEMASS 462.40348000000006 | + | AVERAGEMASS 462.40348000000006 |
| − | SMILES c(c2)cc(c(C(O4)=CC(c(c43)c(cc(c3)OC)O)=O)c(O)2)OC(C(O)1)OC(CO)C(C1O)O | + | SMILES c(c2)cc(c(C(O4)=CC(c(c43)c(cc(c3)OC)O)=O)c(O)2)OC(C(O)1)OC(CO)C(C1O)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
33 36 0 0 0 0 0 0 0 0999 V2000
-1.8013 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8013 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0868 -0.2213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3724 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3724 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0868 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3421 -0.2213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0566 0.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0566 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3421 1.4287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7710 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4855 1.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2000 1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2000 2.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4855 2.6662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7710 2.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3421 -1.0463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5209 1.3632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4855 0.2561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0868 -1.0792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1613 2.6058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6351 -2.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4540 -1.9310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5719 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0896 -0.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2706 -0.5735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1526 -1.3903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5519 -1.3070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1100 -1.6413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8922 -2.6662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0408 -2.2436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0947 -1.5212 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2000 0.9712 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
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
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
18 1 1 0 0 0 0
12 19 1 0 0 0 0
3 20 1 0 0 0 0
16 21 1 0 0 0 0
22 23 1 1 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 22 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
22 30 1 0 0 0 0
23 31 1 0 0 0 0
24 32 1 0 0 0 0
25 19 1 0 0 0 0
18 33 1 0 0 0 0
S SKP 8
ID FL3FA8GS0007
KNApSAcK_ID C00013652
NAME 5,2',6'-Trihydroxy-7-methoxyflavone 2'-O-glucoside;2-[2-(beta-D-Glucopyranosyloxy)-6-hydroxyphenyl]-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one
CAS_RN 223599-62-0
FORMULA C22H22O11
EXACTMASS 462.116211546
AVERAGEMASS 462.40348000000006
SMILES c(c2)cc(c(C(O4)=CC(c(c43)c(cc(c3)OC)O)=O)c(O)2)OC(C(O)1)OC(CO)C(C1O)O
M END
