Mol:FL7AACGL0042
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 54 59 0 0 0 0 0 0 0 0999 V2000 | + | 54 59 0 0 0 0 0 0 0 0999 V2000 |
| − | -3.0485 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0485 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0485 0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0485 0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3338 0.3963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3338 0.3963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6191 0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6191 0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6191 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6191 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3338 2.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3338 2.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9044 0.3963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9044 0.3963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1897 0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1897 0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1897 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1897 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9044 2.0468 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 | + | -0.9044 2.0468 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5248 2.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5248 2.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2532 1.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2532 1.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9815 2.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9815 2.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9815 2.8878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9815 2.8878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2532 3.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2532 3.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5248 2.8878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5248 2.8878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7630 2.0467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7630 2.0467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7099 3.3082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7099 3.3082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3338 -0.4287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3338 -0.4287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5512 0.3780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5512 0.3780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4335 -0.6954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4335 -0.6954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0889 -1.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0889 -1.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7516 -1.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7516 -1.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4183 -1.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4183 -1.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7630 -0.6954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7630 -0.6954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1003 -0.8847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1003 -0.8847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7948 -0.8683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7948 -0.8683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5719 0.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5719 0.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2273 0.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2273 0.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8900 0.4671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8900 0.4671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5566 0.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5566 0.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9013 0.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9013 0.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2386 0.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2386 0.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9567 0.7749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9567 0.7749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6571 1.3008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6571 1.3008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5967 0.8113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5967 0.8113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1692 0.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1692 0.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5702 -0.0518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5702 -0.0518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4860 -1.2936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4860 -1.2936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3125 -1.7559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3125 -1.7559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4183 -1.8737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4183 -1.8737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1345 -1.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1345 -1.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5839 -2.5546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5839 -2.5546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3428 -1.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3428 -1.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2532 4.1492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2532 4.1492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0511 -2.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0511 -2.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7962 -2.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7962 -2.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2092 -2.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2092 -2.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0350 -2.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0350 -2.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4479 -2.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4479 -2.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0350 -3.4347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0350 -3.4347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2092 -3.4347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2092 -3.4347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2729 -2.7196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2729 -2.7196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4475 -4.1492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4475 -4.1492 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 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 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 2 0 0 0 0 | + | 7 8 2 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 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 |
| − | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 20 8 1 0 0 0 0 | + | 20 8 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 23 1 1 0 0 0 | + | 22 23 1 1 0 0 0 |
| − | 23 24 1 1 0 0 0 | + | 23 24 1 1 0 0 0 |
| − | 25 24 1 1 0 0 0 | + | 25 24 1 1 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 21 1 0 0 0 0 | + | 26 21 1 0 0 0 0 |
| − | 21 27 1 0 0 0 0 | + | 21 27 1 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 29 30 1 1 0 0 0 | + | 29 30 1 1 0 0 0 |
| − | 30 31 1 1 0 0 0 | + | 30 31 1 1 0 0 0 |
| − | 32 31 1 1 0 0 0 | + | 32 31 1 1 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | 33 28 1 0 0 0 0 | + | 33 28 1 0 0 0 0 |
| − | 28 34 1 0 0 0 0 | + | 28 34 1 0 0 0 0 |
| − | 33 35 1 0 0 0 0 | + | 33 35 1 0 0 0 0 |
| − | 32 36 1 0 0 0 0 | + | 32 36 1 0 0 0 0 |
| − | 31 37 1 0 0 0 0 | + | 31 37 1 0 0 0 0 |
| − | 25 38 1 0 0 0 0 | + | 25 38 1 0 0 0 0 |
| − | 37 38 1 0 0 0 0 | + | 37 38 1 0 0 0 0 |
| − | 22 39 1 0 0 0 0 | + | 22 39 1 0 0 0 0 |
| − | 23 40 1 0 0 0 0 | + | 23 40 1 0 0 0 0 |
| − | 24 41 1 0 0 0 0 | + | 24 41 1 0 0 0 0 |
| − | 29 20 1 0 0 0 0 | + | 29 20 1 0 0 0 0 |
| − | 39 42 1 0 0 0 0 | + | 39 42 1 0 0 0 0 |
| − | 42 43 2 0 0 0 0 | + | 42 43 2 0 0 0 0 |
| − | 42 44 1 0 0 0 0 | + | 42 44 1 0 0 0 0 |
| − | 15 45 1 0 0 0 0 | + | 15 45 1 0 0 0 0 |
| − | 44 46 2 0 0 0 0 | + | 44 46 2 0 0 0 0 |
| − | 46 47 1 0 0 0 0 | + | 46 47 1 0 0 0 0 |
| − | 47 48 2 0 0 0 0 | + | 47 48 2 0 0 0 0 |
| − | 48 49 1 0 0 0 0 | + | 48 49 1 0 0 0 0 |
| − | 49 50 2 0 0 0 0 | + | 49 50 2 0 0 0 0 |
| − | 50 51 1 0 0 0 0 | + | 50 51 1 0 0 0 0 |
| − | 51 52 2 0 0 0 0 | + | 51 52 2 0 0 0 0 |
| − | 52 47 1 0 0 0 0 | + | 52 47 1 0 0 0 0 |
| − | 50 53 1 0 0 0 0 | + | 50 53 1 0 0 0 0 |
| − | 51 54 1 0 0 0 0 | + | 51 54 1 0 0 0 0 |
| − | M CHG 1 10 1 | + | M CHG 1 10 1 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL7AACGL0042 | + | ID FL7AACGL0042 |
| − | FORMULA C36H37O18 | + | FORMULA C36H37O18 |
| − | EXACTMASS 757.1979893800001 | + | EXACTMASS 757.1979893800001 |
| − | AVERAGEMASS 757.66818 | + | AVERAGEMASS 757.66818 |
| − | SMILES c(c6O)c(O)c(c2c6)cc(OC(O3)C(O)C(C(O)C3COC(C4O)OC(C)C(OC(C=Cc(c5)ccc(c(O)5)O)=O)C4O)O)c([o+1]2)c(c1)cc(O)c(c1)O | + | SMILES c(c6O)c(O)c(c2c6)cc(OC(O3)C(O)C(C(O)C3COC(C4O)OC(C)C(OC(C=Cc(c5)ccc(c(O)5)O)=O)C4O)O)c([o+1]2)c(c1)cc(O)c(c1)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
54 59 0 0 0 0 0 0 0 0999 V2000
-3.0485 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0485 0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3338 0.3963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6191 0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6191 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3338 2.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9044 0.3963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1897 0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1897 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9044 2.0468 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
0.5248 2.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2532 1.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9815 2.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9815 2.8878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2532 3.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5248 2.8878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7630 2.0467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7099 3.3082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3338 -0.4287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5512 0.3780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4335 -0.6954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0889 -1.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7516 -1.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4183 -1.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7630 -0.6954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1003 -0.8847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7948 -0.8683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5719 0.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2273 0.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8900 0.4671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5566 0.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9013 0.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2386 0.6853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9567 0.7749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6571 1.3008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5967 0.8113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1692 0.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5702 -0.0518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4860 -1.2936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3125 -1.7559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4183 -1.8737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1345 -1.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5839 -2.5546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3428 -1.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2532 4.1492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0511 -2.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7962 -2.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2092 -2.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0350 -2.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4479 -2.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0350 -3.4347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2092 -3.4347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2729 -2.7196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4475 -4.1492 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
3 4 1 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 2 0 0 0 0
8 9 1 0 0 0 0
9 10 2 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
1 17 1 0 0 0 0
14 18 1 0 0 0 0
3 19 1 0 0 0 0
20 8 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 1 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 21 1 0 0 0 0
21 27 1 0 0 0 0
28 29 1 0 0 0 0
29 30 1 1 0 0 0
30 31 1 1 0 0 0
32 31 1 1 0 0 0
32 33 1 0 0 0 0
33 28 1 0 0 0 0
28 34 1 0 0 0 0
33 35 1 0 0 0 0
32 36 1 0 0 0 0
31 37 1 0 0 0 0
25 38 1 0 0 0 0
37 38 1 0 0 0 0
22 39 1 0 0 0 0
23 40 1 0 0 0 0
24 41 1 0 0 0 0
29 20 1 0 0 0 0
39 42 1 0 0 0 0
42 43 2 0 0 0 0
42 44 1 0 0 0 0
15 45 1 0 0 0 0
44 46 2 0 0 0 0
46 47 1 0 0 0 0
47 48 2 0 0 0 0
48 49 1 0 0 0 0
49 50 2 0 0 0 0
50 51 1 0 0 0 0
51 52 2 0 0 0 0
52 47 1 0 0 0 0
50 53 1 0 0 0 0
51 54 1 0 0 0 0
M CHG 1 10 1
S SKP 5
ID FL7AACGL0042
FORMULA C36H37O18
EXACTMASS 757.1979893800001
AVERAGEMASS 757.66818
SMILES c(c6O)c(O)c(c2c6)cc(OC(O3)C(O)C(C(O)C3COC(C4O)OC(C)C(OC(C=Cc(c5)ccc(c(O)5)O)=O)C4O)O)c([o+1]2)c(c1)cc(O)c(c1)O
M END
