Mol:FL5FAAGS0122
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 |
| − | 2.3204 3.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3204 3.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3204 2.4512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3204 2.4512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0349 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0349 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7494 2.4512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7494 2.4512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7494 3.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7494 3.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0349 3.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0349 3.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6059 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6059 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8915 2.4512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8915 2.4512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1770 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1770 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1770 1.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1770 1.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8915 0.8012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8915 0.8012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6059 1.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6059 1.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5375 2.4512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5375 2.4512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2519 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2519 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2519 1.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2519 1.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5375 0.8012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5375 0.8012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8915 0.0829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8915 0.0829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9664 2.4512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9664 2.4512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2123 0.8636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2123 0.8636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3501 3.6230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3501 3.6230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5375 0.1017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5375 0.1017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4878 1.7017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4878 1.7017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9003 0.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9003 0.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1070 1.2140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1070 1.2140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3090 1.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3090 1.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8964 1.7193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8964 1.7193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6897 1.4926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6897 1.4926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3136 0.3896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3136 0.3896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5818 0.6108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5818 0.6108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3501 1.1227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3501 1.1227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2221 1.5777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2221 1.5777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4852 -2.2840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4852 -2.2840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8907 -3.0025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8907 -3.0025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6602 -2.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6602 -2.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2407 -2.9864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2407 -2.9864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5842 -2.9783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5842 -2.9783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9897 -2.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9897 -2.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8147 -2.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8147 -2.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2341 -2.9622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2341 -2.9622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8286 -3.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8286 -3.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0037 -3.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0037 -3.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0591 -2.9541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0591 -2.9541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2568 -0.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2568 -0.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2496 -1.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2496 -1.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8284 -0.7813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8284 -0.7813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6260 -0.5703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6260 -0.5703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6333 0.2547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6333 0.2547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0544 -0.3332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0544 -0.3332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0991 -0.9479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0991 -0.9479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7010 -1.6112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7010 -1.6112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7094 -1.4073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7094 -1.4073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7858 -0.9690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7858 -0.9690 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 |
| − | 5 20 1 0 0 0 0 | + | 5 20 1 0 0 0 0 |
| − | 16 21 1 0 0 0 0 | + | 16 21 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 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 |
| − | 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 22 1 0 0 0 0 | + | 27 22 1 0 0 0 0 |
| − | 25 28 1 0 0 0 0 | + | 25 28 1 0 0 0 0 |
| − | 24 29 1 0 0 0 0 | + | 24 29 1 0 0 0 0 |
| − | 23 30 1 0 0 0 0 | + | 23 30 1 0 0 0 0 |
| − | 22 31 1 0 0 0 0 | + | 22 31 1 0 0 0 0 |
| − | 26 18 1 0 0 0 0 | + | 26 18 1 0 0 0 0 |
| − | 32 33 2 0 0 0 0 | + | 32 33 2 0 0 0 0 |
| − | 32 34 1 0 0 0 0 | + | 32 34 1 0 0 0 0 |
| − | 34 35 2 0 0 0 0 | + | 34 35 2 0 0 0 0 |
| − | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
| − | 36 37 2 0 0 0 0 | + | 36 37 2 0 0 0 0 |
| − | 37 38 1 0 0 0 0 | + | 37 38 1 0 0 0 0 |
| − | 38 39 2 0 0 0 0 | + | 38 39 2 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 |
| − | 41 36 1 0 0 0 0 | + | 41 36 1 0 0 0 0 |
| − | 39 42 1 0 0 0 0 | + | 39 42 1 0 0 0 0 |
| − | 43 44 1 0 0 0 0 | + | 43 44 1 0 0 0 0 |
| − | 44 45 1 1 0 0 0 | + | 44 45 1 1 0 0 0 |
| − | 46 45 1 1 0 0 0 | + | 46 45 1 1 0 0 0 |
| − | 47 46 1 1 0 0 0 | + | 47 46 1 1 0 0 0 |
| − | 47 48 1 0 0 0 0 | + | 47 48 1 0 0 0 0 |
| − | 48 43 1 0 0 0 0 | + | 48 43 1 0 0 0 0 |
| − | 46 49 1 0 0 0 0 | + | 46 49 1 0 0 0 0 |
| − | 45 50 1 0 0 0 0 | + | 45 50 1 0 0 0 0 |
| − | 44 51 1 0 0 0 0 | + | 44 51 1 0 0 0 0 |
| − | 43 52 1 0 0 0 0 | + | 43 52 1 0 0 0 0 |
| − | 47 19 1 0 0 0 0 | + | 47 19 1 0 0 0 0 |
| − | 32 50 1 0 0 0 0 | + | 32 50 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FAAGS0122 | + | ID FL5FAAGS0122 |
| − | FORMULA C36H36O16 | + | FORMULA C36H36O16 |
| − | EXACTMASS 724.200335104 | + | EXACTMASS 724.200335104 |
| − | AVERAGEMASS 724.66144 | + | AVERAGEMASS 724.66144 |
| − | SMILES Oc(c6)ccc(c6)C(O1)=C(OC(C(O)4)OC(C(C4OC(C=Cc(c5)ccc(c5)O)=O)O)C)C(c(c2O)c(cc(OC(O3)C(O)C(C(C3C)O)O)c2)1)=O | + | SMILES Oc(c6)ccc(c6)C(O1)=C(OC(C(O)4)OC(C(C4OC(C=Cc(c5)ccc(c5)O)=O)O)C)C(c(c2O)c(cc(OC(O3)C(O)C(C(C3C)O)O)c2)1)=O |
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
2.3204 3.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3204 2.4512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0349 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7494 2.4512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7494 3.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0349 3.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6059 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8915 2.4512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1770 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1770 1.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8915 0.8012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6059 1.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5375 2.4512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2519 2.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2519 1.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5375 0.8012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8915 0.0829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9664 2.4512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2123 0.8636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3501 3.6230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5375 0.1017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4878 1.7017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9003 0.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1070 1.2140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3090 1.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8964 1.7193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6897 1.4926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3136 0.3896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5818 0.6108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3501 1.1227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2221 1.5777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4852 -2.2840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8907 -3.0025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6602 -2.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2407 -2.9864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5842 -2.9783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9897 -2.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8147 -2.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2341 -2.9622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8286 -3.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0037 -3.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0591 -2.9541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2568 -0.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2496 -1.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8284 -0.7813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6260 -0.5703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6333 0.2547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0544 -0.3332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0991 -0.9479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7010 -1.6112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7094 -1.4073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7858 -0.9690 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
5 20 1 0 0 0 0
16 21 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
26 25 1 1 0 0 0
26 27 1 0 0 0 0
27 22 1 0 0 0 0
25 28 1 0 0 0 0
24 29 1 0 0 0 0
23 30 1 0 0 0 0
22 31 1 0 0 0 0
26 18 1 0 0 0 0
32 33 2 0 0 0 0
32 34 1 0 0 0 0
34 35 2 0 0 0 0
35 36 1 0 0 0 0
36 37 2 0 0 0 0
37 38 1 0 0 0 0
38 39 2 0 0 0 0
39 40 1 0 0 0 0
40 41 2 0 0 0 0
41 36 1 0 0 0 0
39 42 1 0 0 0 0
43 44 1 0 0 0 0
44 45 1 1 0 0 0
46 45 1 1 0 0 0
47 46 1 1 0 0 0
47 48 1 0 0 0 0
48 43 1 0 0 0 0
46 49 1 0 0 0 0
45 50 1 0 0 0 0
44 51 1 0 0 0 0
43 52 1 0 0 0 0
47 19 1 0 0 0 0
32 50 1 0 0 0 0
S SKP 5
ID FL5FAAGS0122
FORMULA C36H36O16
EXACTMASS 724.200335104
AVERAGEMASS 724.66144
SMILES Oc(c6)ccc(c6)C(O1)=C(OC(C(O)4)OC(C(C4OC(C=Cc(c5)ccc(c5)O)=O)O)C)C(c(c2O)c(cc(OC(O3)C(O)C(C(C3C)O)O)c2)1)=O
M END
