Mol:FL3FEAGS0052
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 34 37 0 0 0 0 0 0 0 0999 V2000 | + | 34 37 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.1987 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1987 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1987 -0.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1987 -0.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4842 -0.8580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4842 -0.8580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2302 -0.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2302 -0.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2302 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2302 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4842 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4842 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9447 -0.8580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9447 -0.8580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6592 -0.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6592 -0.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6592 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6592 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9447 0.7920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9447 0.7920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3736 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3736 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0881 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0881 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8026 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8026 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8026 1.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8026 1.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0881 2.0295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0881 2.0295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3736 1.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3736 1.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9447 -1.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9447 -1.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4842 -1.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4842 -1.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5489 2.0479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5489 2.0479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9183 0.7265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9183 0.7265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8857 -0.8421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8857 -0.8421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.2145 1.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.2145 1.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6696 1.1816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6696 1.1816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2570 0.4669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2570 0.4669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4587 0.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4587 0.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6652 0.4492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6652 0.4492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0778 1.1639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0778 1.1639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8761 0.9549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8761 0.9549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2828 0.0196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2828 0.0196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.2145 0.6368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.2145 0.6368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6840 0.5813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6840 0.5813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0591 1.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0591 1.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5971 1.7817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5971 1.7817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1164 -2.0479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1164 -2.0479 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 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
| − | 20 1 1 0 0 0 0 | + | 20 1 1 0 0 0 0 |
| − | 2 21 1 0 0 0 0 | + | 2 21 1 0 0 0 0 |
| − | 19 22 1 0 0 0 0 | + | 19 22 1 0 0 0 0 |
| − | 23 24 1 1 0 0 0 | + | 23 24 1 1 0 0 0 |
| − | 24 25 1 1 0 0 0 | + | 24 25 1 1 0 0 0 |
| − | 26 25 1 1 0 0 0 | + | 26 25 1 1 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 23 1 0 0 0 0 | + | 28 23 1 0 0 0 0 |
| − | 25 29 1 0 0 0 0 | + | 25 29 1 0 0 0 0 |
| − | 23 30 1 0 0 0 0 | + | 23 30 1 0 0 0 0 |
| − | 24 31 1 0 0 0 0 | + | 24 31 1 0 0 0 0 |
| − | 28 32 1 0 0 0 0 | + | 28 32 1 0 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | 20 26 1 0 0 0 0 | + | 20 26 1 0 0 0 0 |
| − | 18 34 1 0 0 0 0 | + | 18 34 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FEAGS0052 | + | ID FL3FEAGS0052 |
| − | KNApSAcK_ID C00013639 | + | KNApSAcK_ID C00013639 |
| − | NAME Scutellarein 5,4'-dimethyl ether 7-glucoside;7-(beta-D-Glucopyranosyloxy)-6-hydroxy-5-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one | + | NAME Scutellarein 5,4'-dimethyl ether 7-glucoside;7-(beta-D-Glucopyranosyloxy)-6-hydroxy-5-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 186466-61-5 | + | CAS_RN 186466-61-5 |
| − | FORMULA C23H24O11 | + | FORMULA C23H24O11 |
| − | EXACTMASS 476.13186161 | + | EXACTMASS 476.13186161 |
| − | AVERAGEMASS 476.43006 | + | AVERAGEMASS 476.43006 |
| − | SMILES O(C)c(c(O)3)c(c2cc3OC(C(O)4)OC(CO)C(C4O)O)C(=O)C=C(O2)c(c1)ccc(OC)c1 | + | SMILES O(C)c(c(O)3)c(c2cc3OC(C(O)4)OC(CO)C(C4O)O)C(=O)C=C(O2)c(c1)ccc(OC)c1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
34 37 0 0 0 0 0 0 0 0999 V2000
-1.1987 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1987 -0.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4842 -0.8580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2302 -0.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2302 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4842 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9447 -0.8580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6592 -0.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6592 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9447 0.7920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3736 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0881 0.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8026 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8026 1.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0881 2.0295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3736 1.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9447 -1.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4842 -1.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5489 2.0479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9183 0.7265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8857 -0.8421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2145 1.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6696 1.1816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2570 0.4669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4587 0.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6652 0.4492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0778 1.1639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8761 0.9549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2828 0.0196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2145 0.6368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.6840 0.5813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0591 1.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5971 1.7817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1164 -2.0479 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
3 18 1 0 0 0 0
14 19 1 0 0 0 0
20 1 1 0 0 0 0
2 21 1 0 0 0 0
19 22 1 0 0 0 0
23 24 1 1 0 0 0
24 25 1 1 0 0 0
26 25 1 1 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
28 23 1 0 0 0 0
25 29 1 0 0 0 0
23 30 1 0 0 0 0
24 31 1 0 0 0 0
28 32 1 0 0 0 0
32 33 1 0 0 0 0
20 26 1 0 0 0 0
18 34 1 0 0 0 0
S SKP 8
ID FL3FEAGS0052
KNApSAcK_ID C00013639
NAME Scutellarein 5,4'-dimethyl ether 7-glucoside;7-(beta-D-Glucopyranosyloxy)-6-hydroxy-5-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 186466-61-5
FORMULA C23H24O11
EXACTMASS 476.13186161
AVERAGEMASS 476.43006
SMILES O(C)c(c(O)3)c(c2cc3OC(C(O)4)OC(CO)C(C4O)O)C(=O)C=C(O2)c(c1)ccc(OC)c1
M END
