Mol:FL5F1GGS0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 43 47 0 0 0 0 0 0 0 0999 V2000 | + | 43 47 0 0 0 0 0 0 0 0999 V2000 |
| − | 2.1779 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1779 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4634 1.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4634 1.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4634 2.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4634 2.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1779 3.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1779 3.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8923 2.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8923 2.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8923 1.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8923 1.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7490 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7490 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0346 1.8737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0346 1.8737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6799 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6799 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6799 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6799 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0346 0.2238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0346 0.2238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7490 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7490 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3944 1.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3944 1.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1088 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1088 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1088 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1088 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3944 0.2238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3944 0.2238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0346 -0.4832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0346 -0.4832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8232 1.8737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8232 1.8737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5245 0.1441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5245 0.1441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6068 3.1112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6068 3.1112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1779 3.9361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1779 3.9361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5703 1.4823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5703 1.4823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4839 -1.7690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4839 -1.7690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3253 -1.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3253 -1.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6950 -1.1928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6950 -1.1928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3890 -0.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3890 -0.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5798 -0.5847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5798 -0.5847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2100 -1.3225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2100 -1.3225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4500 -1.1653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4500 -1.1653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5565 -2.4362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5565 -2.4362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0016 -2.3849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0016 -2.3849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4222 -1.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4222 -1.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0066 -1.8176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0066 -1.8176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6387 -2.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6387 -2.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0288 -3.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0288 -3.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2428 -3.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2428 -3.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4383 -3.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4383 -3.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0483 -2.5017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0483 -2.5017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8342 -2.7532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8342 -2.7532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6068 -3.1028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6068 -3.1028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3514 -2.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3514 -2.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7269 -3.7526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7269 -3.7526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3896 -3.9361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3896 -3.9361 0.0000 O 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 |
| − | 5 20 1 0 0 0 0 | + | 5 20 1 0 0 0 0 |
| − | 4 21 1 0 0 0 0 | + | 4 21 1 0 0 0 0 |
| − | 6 22 1 0 0 0 0 | + | 6 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 |
| − | 34 35 1 0 0 0 0 | + | 34 35 1 0 0 0 0 |
| − | 35 36 1 1 0 0 0 | + | 35 36 1 1 0 0 0 |
| − | 37 36 1 1 0 0 0 | + | 37 36 1 1 0 0 0 |
| − | 38 37 1 1 0 0 0 | + | 38 37 1 1 0 0 0 |
| − | 38 39 1 0 0 0 0 | + | 38 39 1 0 0 0 0 |
| − | 39 34 1 0 0 0 0 | + | 39 34 1 0 0 0 0 |
| − | 35 40 1 0 0 0 0 | + | 35 40 1 0 0 0 0 |
| − | 34 41 1 0 0 0 0 | + | 34 41 1 0 0 0 0 |
| − | 36 42 1 0 0 0 0 | + | 36 42 1 0 0 0 0 |
| − | 37 43 1 0 0 0 0 | + | 37 43 1 0 0 0 0 |
| − | 33 38 1 0 0 0 0 | + | 33 38 1 0 0 0 0 |
| − | 26 19 1 0 0 0 0 | + | 26 19 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5F1GGS0002 | + | ID FL5F1GGS0002 |
| − | FORMULA C27H30O16 | + | FORMULA C27H30O16 |
| − | EXACTMASS 610.153384912 | + | EXACTMASS 610.153384912 |
| − | AVERAGEMASS 610.5175 | + | AVERAGEMASS 610.5175 |
| − | SMILES O(C1C)C(OCC(C(O)5)OC(C(O)C(O)5)OC(C(=O)2)=C(c(c4)cc(c(c(O)4)O)O)Oc(c3)c2ccc(O)3)C(C(O)C(O)1)O | + | SMILES O(C1C)C(OCC(C(O)5)OC(C(O)C(O)5)OC(C(=O)2)=C(c(c4)cc(c(c(O)4)O)O)Oc(c3)c2ccc(O)3)C(C(O)C(O)1)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
43 47 0 0 0 0 0 0 0 0999 V2000
2.1779 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4634 1.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4634 2.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1779 3.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8923 2.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8923 1.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7490 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0346 1.8737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6799 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6799 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0346 0.2238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7490 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3944 1.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1088 1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1088 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3944 0.2238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0346 -0.4832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8232 1.8737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5245 0.1441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6068 3.1112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1779 3.9361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5703 1.4823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4839 -1.7690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3253 -1.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6950 -1.1928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3890 -0.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5798 -0.5847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2100 -1.3225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4500 -1.1653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5565 -2.4362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0016 -2.3849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4222 -1.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0066 -1.8176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6387 -2.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0288 -3.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2428 -3.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4383 -3.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0483 -2.5017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8342 -2.7532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6068 -3.1028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3514 -2.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7269 -3.7526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3896 -3.9361 0.0000 O 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
5 20 1 0 0 0 0
4 21 1 0 0 0 0
6 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
34 35 1 0 0 0 0
35 36 1 1 0 0 0
37 36 1 1 0 0 0
38 37 1 1 0 0 0
38 39 1 0 0 0 0
39 34 1 0 0 0 0
35 40 1 0 0 0 0
34 41 1 0 0 0 0
36 42 1 0 0 0 0
37 43 1 0 0 0 0
33 38 1 0 0 0 0
26 19 1 0 0 0 0
S SKP 5
ID FL5F1GGS0002
FORMULA C27H30O16
EXACTMASS 610.153384912
AVERAGEMASS 610.5175
SMILES O(C1C)C(OCC(C(O)5)OC(C(O)C(O)5)OC(C(=O)2)=C(c(c4)cc(c(c(O)4)O)O)Oc(c3)c2ccc(O)3)C(C(O)C(O)1)O
M END
