Mol:FL5FFAGS0014
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 |
| − | -0.6861 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6861 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6861 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6861 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0184 -1.7748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0184 -1.7748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7229 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7229 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7229 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7229 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0184 -0.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0184 -0.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4274 -1.7748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4274 -1.7748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1319 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1319 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1319 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1319 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4274 -0.1478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4274 -0.1478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4274 -2.5053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4274 -2.5053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0191 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0191 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7371 -0.4058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7371 -0.4058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4550 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4550 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4550 0.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4550 0.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7371 1.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7371 1.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0191 0.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0191 0.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0184 -2.5880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0184 -2.5880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.2235 1.2816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.2235 1.2816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8453 -1.8866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8453 -1.8866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3763 -0.1560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3763 -0.1560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0184 0.6654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0184 0.6654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2241 1.0110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2241 1.0110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5049 1.4262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5049 1.4262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3106 1.6278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3106 1.6278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8922 2.2271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8922 2.2271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6115 1.8120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6115 1.8120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8058 1.6102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8058 1.6102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1099 2.4547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1099 2.4547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4634 2.5880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4634 2.5880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6386 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6386 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5948 1.8906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5948 1.8906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7631 0.7948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7631 0.7948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2210 -0.0471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2210 -0.0471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6334 -0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6334 -0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8402 -0.5348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8402 -0.5348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0422 -0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0422 -0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6296 -0.0471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6296 -0.0471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4229 -0.2737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4229 -0.2737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.4040 -1.1635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4040 -1.1635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.2235 -0.5161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.2235 -0.5161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.9514 -0.1577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.9514 -0.1577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0408 -1.4887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0408 -1.4887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 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 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 19 15 1 0 0 0 0 | + | 19 15 1 0 0 0 0 |
| − | 20 8 1 0 0 0 0 | + | 20 8 1 0 0 0 0 |
| − | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
| − | 1 21 1 0 0 0 0 | + | 1 21 1 0 0 0 0 |
| − | 6 22 1 0 0 0 0 | + | 6 22 1 0 0 0 0 |
| − | 24 23 1 1 0 0 0 | + | 24 23 1 1 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 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 28 1 1 0 0 0 | + | 27 28 1 1 0 0 0 |
| − | 28 23 1 1 0 0 0 | + | 28 23 1 1 0 0 0 |
| − | 27 29 1 0 0 0 0 | + | 27 29 1 0 0 0 0 |
| − | 26 30 1 0 0 0 0 | + | 26 30 1 0 0 0 0 |
| − | 28 31 1 0 0 0 0 | + | 28 31 1 0 0 0 0 |
| − | 25 32 1 0 0 0 0 | + | 25 32 1 0 0 0 0 |
| − | 24 22 1 0 0 0 0 | + | 24 22 1 0 0 0 0 |
| − | 31 33 1 0 0 0 0 | + | 31 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 |
| − | 36 37 1 1 0 0 0 | + | 36 37 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 |
| − | 36 40 1 0 0 0 0 | + | 36 40 1 0 0 0 0 |
| − | 35 41 1 0 0 0 0 | + | 35 41 1 0 0 0 0 |
| − | 34 42 1 0 0 0 0 | + | 34 42 1 0 0 0 0 |
| − | 37 43 1 0 0 0 0 | + | 37 43 1 0 0 0 0 |
| − | 38 33 1 0 0 0 0 | + | 38 33 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FFAGS0014 | + | ID FL5FFAGS0014 |
| − | FORMULA C27H30O16 | + | FORMULA C27H30O16 |
| − | EXACTMASS 610.153384912 | + | EXACTMASS 610.153384912 |
| − | AVERAGEMASS 610.5175 | + | AVERAGEMASS 610.5175 |
| − | SMILES c(O1)(c3OC(O4)C(O)C(O)C(C4COC(O5)C(C(O)C(O)C5C)O)O)c(c(cc(O)3)O)C(C(=C1c(c2)ccc(O)c2)O)=O | + | SMILES c(O1)(c3OC(O4)C(O)C(O)C(C4COC(O5)C(C(O)C(O)C5C)O)O)c(c(cc(O)3)O)C(C(=C1c(c2)ccc(O)c2)O)=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
-0.6861 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6861 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0184 -1.7748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7229 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7229 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0184 -0.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4274 -1.7748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1319 -1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1319 -0.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4274 -0.1478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4274 -2.5053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0191 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7371 -0.4058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4550 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4550 0.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7371 1.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0191 0.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0184 -2.5880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2235 1.2816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8453 -1.8866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3763 -0.1560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0184 0.6654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2241 1.0110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5049 1.4262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3106 1.6278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8922 2.2271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6115 1.8120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8058 1.6102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1099 2.4547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4634 2.5880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6386 1.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5948 1.8906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7631 0.7948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2210 -0.0471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6334 -0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8402 -0.5348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0422 -0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6296 -0.0471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4229 -0.2737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4040 -1.1635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2235 -0.5161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9514 -0.1577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0408 -1.4887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 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
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
3 18 1 0 0 0 0
19 15 1 0 0 0 0
20 8 1 0 0 0 0
4 3 1 0 0 0 0
1 21 1 0 0 0 0
6 22 1 0 0 0 0
24 23 1 1 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 1 1 0 0 0
28 23 1 1 0 0 0
27 29 1 0 0 0 0
26 30 1 0 0 0 0
28 31 1 0 0 0 0
25 32 1 0 0 0 0
24 22 1 0 0 0 0
31 33 1 0 0 0 0
34 35 1 0 0 0 0
35 36 1 1 0 0 0
36 37 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
36 40 1 0 0 0 0
35 41 1 0 0 0 0
34 42 1 0 0 0 0
37 43 1 0 0 0 0
38 33 1 0 0 0 0
S SKP 5
ID FL5FFAGS0014
FORMULA C27H30O16
EXACTMASS 610.153384912
AVERAGEMASS 610.5175
SMILES c(O1)(c3OC(O4)C(O)C(O)C(C4COC(O5)C(C(O)C(O)C5C)O)O)c(c(cc(O)3)O)C(C(=C1c(c2)ccc(O)c2)O)=O
M END
