Mol:FL5FACGS0092
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 35 38 0 0 0 0 0 0 0 0999 V2000 | + | 35 38 0 0 0 0 0 0 0 0999 V2000 |
| − | 1.0224 2.2139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0224 2.2139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0224 1.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0224 1.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7368 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7368 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4513 1.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4513 1.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4513 2.2139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4513 2.2139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7368 2.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7368 2.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3080 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3080 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4065 1.3890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4065 1.3890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1210 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1210 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1210 0.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1210 0.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4065 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4065 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3080 0.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3080 0.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8354 1.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8354 1.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5499 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5499 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5499 0.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5499 0.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8354 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8354 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4065 -1.0860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4065 -1.0860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2643 1.3890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2643 1.3890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0224 -0.2610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0224 -0.2610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8354 -1.0860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8354 -1.0860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0432 2.5557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0432 2.5557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0799 1.0261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0799 1.0261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0975 -1.5122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0975 -1.5122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0114 -2.3329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0114 -2.3329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6440 -1.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6440 -1.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4582 -1.6691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4582 -1.6691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5444 -0.8484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5444 -0.8484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9119 -1.3784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9119 -1.3784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4369 -2.6264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4369 -2.6264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5424 -2.4207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5424 -2.4207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4760 -1.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4760 -1.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8050 -2.3335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8050 -2.3335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5455 -1.1879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5455 -1.1879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5374 -1.9775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5374 -1.9775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2643 -2.3723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2643 -2.3723 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 |
| − | 2 7 1 0 0 0 0 | + | 2 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 7 2 0 0 0 0 | + | 12 7 2 0 0 0 0 |
| − | 9 13 1 0 0 0 0 | + | 9 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 10 1 0 0 0 0 | + | 16 10 1 0 0 0 0 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 11 17 2 0 0 0 0 | + | 11 17 2 0 0 0 0 |
| − | 12 19 1 0 0 0 0 | + | 12 19 1 0 0 0 0 |
| − | 16 20 1 0 0 0 0 | + | 16 20 1 0 0 0 0 |
| − | 5 21 1 0 0 0 0 | + | 5 21 1 0 0 0 0 |
| − | 4 22 1 0 0 0 0 | + | 4 22 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 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 |
| − | 27 26 1 1 0 0 0 | + | 27 26 1 1 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 |
| − | 26 32 1 0 0 0 0 | + | 26 32 1 0 0 0 0 |
| − | 25 29 1 0 0 0 0 | + | 25 29 1 0 0 0 0 |
| − | 24 30 1 0 0 0 0 | + | 24 30 1 0 0 0 0 |
| − | 23 31 1 0 0 0 0 | + | 23 31 1 0 0 0 0 |
| − | 32 34 1 0 0 0 0 | + | 32 34 1 0 0 0 0 |
| − | 33 34 2 0 0 0 0 | + | 33 34 2 0 0 0 0 |
| − | 34 35 1 0 0 0 0 | + | 34 35 1 0 0 0 0 |
| − | 27 19 1 0 0 0 0 | + | 27 19 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FACGS0092 | + | ID FL5FACGS0092 |
| − | FORMULA C23H22O12 | + | FORMULA C23H22O12 |
| − | EXACTMASS 490.111126168 | + | EXACTMASS 490.111126168 |
| − | AVERAGEMASS 490.41358 | + | AVERAGEMASS 490.41358 |
| − | SMILES C(C)(C(O)1)OC(OC(C3=O)=C(c(c4)cc(c(O)c4)O)Oc(c32)cc(cc2O)O)C(OC(C)=O)C(O)1 | + | SMILES C(C)(C(O)1)OC(OC(C3=O)=C(c(c4)cc(c(O)c4)O)Oc(c32)cc(cc2O)O)C(OC(C)=O)C(O)1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
35 38 0 0 0 0 0 0 0 0999 V2000
1.0224 2.2139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0224 1.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7368 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4513 1.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4513 2.2139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7368 2.6264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3080 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4065 1.3890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1210 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1210 0.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4065 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3080 0.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8354 1.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5499 0.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5499 0.1515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8354 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4065 -1.0860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2643 1.3890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0224 -0.2610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8354 -1.0860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0432 2.5557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0799 1.0261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0975 -1.5122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0114 -2.3329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6440 -1.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4582 -1.6691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5444 -0.8484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9119 -1.3784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4369 -2.6264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5424 -2.4207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4760 -1.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8050 -2.3335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5455 -1.1879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5374 -1.9775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2643 -2.3723 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
2 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 7 2 0 0 0 0
9 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 10 1 0 0 0 0
14 18 1 0 0 0 0
11 17 2 0 0 0 0
12 19 1 0 0 0 0
16 20 1 0 0 0 0
5 21 1 0 0 0 0
4 22 1 0 0 0 0
23 24 1 0 0 0 0
24 25 1 1 0 0 0
26 25 1 1 0 0 0
27 26 1 1 0 0 0
27 28 1 0 0 0 0
28 23 1 0 0 0 0
26 32 1 0 0 0 0
25 29 1 0 0 0 0
24 30 1 0 0 0 0
23 31 1 0 0 0 0
32 34 1 0 0 0 0
33 34 2 0 0 0 0
34 35 1 0 0 0 0
27 19 1 0 0 0 0
S SKP 5
ID FL5FACGS0092
FORMULA C23H22O12
EXACTMASS 490.111126168
AVERAGEMASS 490.41358
SMILES C(C)(C(O)1)OC(OC(C3=O)=C(c(c4)cc(c(O)c4)O)Oc(c32)cc(cc2O)O)C(OC(C)=O)C(O)1
M END
