Mol:FL2F1AGS0011
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 52 57 0 0 0 0 0 0 0 0999 V2000 | + | 52 57 0 0 0 0 0 0 0 0999 V2000 |
| − | -3.4187 1.7229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4187 1.7229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7061 2.1386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7061 2.1386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4155 0.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4155 0.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6988 0.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6988 0.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9861 0.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9861 0.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9898 1.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9898 1.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2697 0.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2697 0.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5571 0.9106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5571 0.9106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5607 1.7356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5607 1.7356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2770 2.1449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2770 2.1449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0930 2.1164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0930 2.1164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8091 1.7067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8091 1.7067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5220 2.1219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5220 2.1219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5188 2.9469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5188 2.9469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8027 3.3566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8027 3.3566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0898 2.9414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0898 2.9414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2687 -0.1483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2687 -0.1483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0442 2.0840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0442 2.0840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2261 3.3552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2261 3.3552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6776 0.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6776 0.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4938 0.9071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4938 0.9071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5913 1.7266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5913 1.7266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0929 2.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0929 2.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2766 2.2597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2766 2.2597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1790 1.4401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1790 1.4401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7128 1.4077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7128 1.4077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2792 0.9741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2792 0.9741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6776 0.1311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6776 0.1311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1947 0.3891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1947 0.3891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4866 1.9852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4866 1.9852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7470 -0.8054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7470 -0.8054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2076 -1.2660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2076 -1.2660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0442 -0.4281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0442 -0.4281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2359 -0.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2359 -0.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5897 0.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5897 0.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2341 -0.8090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2341 -0.8090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5842 0.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5842 0.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7295 0.0521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7295 0.0521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2591 -0.5929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2591 -0.5929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4960 -0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4960 -0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4960 0.5624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4960 0.5624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1434 -0.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1434 -0.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8653 -0.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8653 -0.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2223 -1.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2223 -1.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0473 -1.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0473 -1.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4598 -1.9485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4598 -1.9485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0473 -2.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0473 -2.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2223 -2.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2223 -2.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8098 -1.9485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8098 -1.9485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4142 -3.2985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4142 -3.2985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8240 -3.3566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8240 -3.3566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0444 -3.3566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0444 -3.3566 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 |
| − | 1 3 1 0 0 0 0 | + | 1 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 2 1 0 0 0 0 | + | 6 2 1 0 0 0 0 |
| − | 5 7 1 0 0 0 0 | + | 5 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 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 6 1 0 0 0 0 | + | 10 6 1 0 0 0 0 |
| − | 9 11 1 6 0 0 0 | + | 9 11 1 6 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 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
| − | 20 21 1 1 0 0 0 | + | 20 21 1 1 0 0 0 |
| − | 21 22 1 1 0 0 0 | + | 21 22 1 1 0 0 0 |
| − | 23 22 1 1 0 0 0 | + | 23 22 1 1 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 20 1 0 0 0 0 | + | 25 20 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 |
| − | 20 28 1 0 0 0 0 | + | 20 28 1 0 0 0 0 |
| − | 21 29 1 0 0 0 0 | + | 21 29 1 0 0 0 0 |
| − | 22 30 1 0 0 0 0 | + | 22 30 1 0 0 0 0 |
| − | 23 19 1 0 0 0 0 | + | 23 19 1 0 0 0 0 |
| − | 37 31 1 1 0 0 0 | + | 37 31 1 1 0 0 0 |
| − | 36 31 1 1 0 0 0 | + | 36 31 1 1 0 0 0 |
| − | 35 37 1 1 0 0 0 | + | 35 37 1 1 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | 37 33 1 0 0 0 0 | + | 37 33 1 0 0 0 0 |
| − | 38 35 1 0 0 0 0 | + | 38 35 1 0 0 0 0 |
| − | 34 39 1 0 0 0 0 | + | 34 39 1 0 0 0 0 |
| − | 36 38 1 0 0 0 0 | + | 36 38 1 0 0 0 0 |
| − | 31 34 1 0 0 0 0 | + | 31 34 1 0 0 0 0 |
| − | 30 35 1 0 0 0 0 | + | 30 35 1 0 0 0 0 |
| − | 39 40 1 0 0 0 0 | + | 39 40 1 0 0 0 0 |
| − | 40 41 2 0 0 0 0 | + | 40 41 2 0 0 0 0 |
| − | 40 42 1 0 0 0 0 | + | 40 42 1 0 0 0 0 |
| − | 42 43 2 0 0 0 0 | + | 42 43 2 0 0 0 0 |
| − | 43 44 1 0 0 0 0 | + | 43 44 1 0 0 0 0 |
| − | 44 45 2 0 0 0 0 | + | 44 45 2 0 0 0 0 |
| − | 45 46 1 0 0 0 0 | + | 45 46 1 0 0 0 0 |
| − | 46 47 2 0 0 0 0 | + | 46 47 2 0 0 0 0 |
| − | 47 48 1 0 0 0 0 | + | 47 48 1 0 0 0 0 |
| − | 48 49 2 0 0 0 0 | + | 48 49 2 0 0 0 0 |
| − | 49 44 1 0 0 0 0 | + | 49 44 1 0 0 0 0 |
| − | 47 50 1 0 0 0 0 | + | 47 50 1 0 0 0 0 |
| − | 48 51 1 0 0 0 0 | + | 48 51 1 0 0 0 0 |
| − | 51 52 1 0 0 0 0 | + | 51 52 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL2F1AGS0011 | + | ID FL2F1AGS0011 |
| − | FORMULA C36H38O16 | + | FORMULA C36H38O16 |
| − | EXACTMASS 726.215985168 | + | EXACTMASS 726.215985168 |
| − | AVERAGEMASS 726.67732 | + | AVERAGEMASS 726.67732 |
| − | SMILES C(C(COC(=O)C=Cc(c6)ccc(O)c(OC)6)(O)5)OC(C(O)5)OC(C1O)C(Oc(c4)ccc(c4)C(C3)Oc(c2C3=O)cc(cc2)O)OC(C1O)CO | + | SMILES C(C(COC(=O)C=Cc(c6)ccc(O)c(OC)6)(O)5)OC(C(O)5)OC(C1O)C(Oc(c4)ccc(c4)C(C3)Oc(c2C3=O)cc(cc2)O)OC(C1O)CO |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
52 57 0 0 0 0 0 0 0 0999 V2000
-3.4187 1.7229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7061 2.1386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4155 0.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6988 0.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9861 0.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9898 1.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2697 0.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5571 0.9106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5607 1.7356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2770 2.1449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0930 2.1164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8091 1.7067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5220 2.1219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5188 2.9469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8027 3.3566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0898 2.9414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2687 -0.1483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0442 2.0840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2261 3.3552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6776 0.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4938 0.9071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5913 1.7266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0929 2.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2766 2.2597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1790 1.4401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7128 1.4077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2792 0.9741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6776 0.1311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1947 0.3891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4866 1.9852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7470 -0.8054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2076 -1.2660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0442 -0.4281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2359 -0.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5897 0.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2341 -0.8090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5842 0.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7295 0.0521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2591 -0.5929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4960 -0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4960 0.5624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1434 -0.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8653 -0.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2223 -1.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0473 -1.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4598 -1.9485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0473 -2.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2223 -2.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8098 -1.9485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4142 -3.2985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8240 -3.3566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0444 -3.3566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 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 2 1 0 0 0 0
5 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 6 1 0 0 0 0
9 11 1 6 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
1 18 1 0 0 0 0
14 19 1 0 0 0 0
20 21 1 1 0 0 0
21 22 1 1 0 0 0
23 22 1 1 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 20 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
20 28 1 0 0 0 0
21 29 1 0 0 0 0
22 30 1 0 0 0 0
23 19 1 0 0 0 0
37 31 1 1 0 0 0
36 31 1 1 0 0 0
35 37 1 1 0 0 0
31 32 1 0 0 0 0
37 33 1 0 0 0 0
38 35 1 0 0 0 0
34 39 1 0 0 0 0
36 38 1 0 0 0 0
31 34 1 0 0 0 0
30 35 1 0 0 0 0
39 40 1 0 0 0 0
40 41 2 0 0 0 0
40 42 1 0 0 0 0
42 43 2 0 0 0 0
43 44 1 0 0 0 0
44 45 2 0 0 0 0
45 46 1 0 0 0 0
46 47 2 0 0 0 0
47 48 1 0 0 0 0
48 49 2 0 0 0 0
49 44 1 0 0 0 0
47 50 1 0 0 0 0
48 51 1 0 0 0 0
51 52 1 0 0 0 0
S SKP 5
ID FL2F1AGS0011
FORMULA C36H38O16
EXACTMASS 726.215985168
AVERAGEMASS 726.67732
SMILES C(C(COC(=O)C=Cc(c6)ccc(O)c(OC)6)(O)5)OC(C(O)5)OC(C1O)C(Oc(c4)ccc(c4)C(C3)Oc(c2C3=O)cc(cc2)O)OC(C1O)CO
M END
