Mol:FL5FAAGS0108
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 53 58 0 0 0 0 0 0 0 0999 V2000 | + | 53 58 0 0 0 0 0 0 0 0999 V2000 |
| − | 0.1446 3.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1446 3.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1446 2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1446 2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8591 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8591 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5737 2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5737 2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5737 3.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5737 3.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8591 4.0693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8591 4.0693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5699 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5699 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2843 2.8318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2843 2.8318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9989 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9989 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9989 1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9989 1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2843 1.1817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2843 1.1817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5699 1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5699 1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7134 2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7134 2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4278 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4278 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4278 1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4278 1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7134 1.1817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7134 1.1817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2843 0.4635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2843 0.4635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1424 2.8318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1424 2.8318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0365 1.2442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0365 1.2442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1744 4.0036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1744 4.0036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7134 0.4822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7134 0.4822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9582 -1.9286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9582 -1.9286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2696 -2.1560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2696 -2.1560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5730 -2.2381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5730 -2.2381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1479 -2.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1479 -2.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4889 -1.5147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4889 -1.5147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0842 -0.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0842 -0.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5045 -0.0858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5045 -0.0858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3295 -0.0948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3295 -0.0948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7342 -0.8138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7342 -0.8138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3139 -1.5237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3139 -1.5237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6156 0.3884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6156 0.3884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5217 -0.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5217 -0.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4105 -1.1124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4105 -1.1124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0781 -0.4475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0781 -0.4475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8372 -0.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8372 -0.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7260 0.6933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7260 0.6933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2375 0.0284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2375 0.0284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3466 -0.6817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3466 -0.6817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0824 -1.2713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0824 -1.2713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9267 -1.1826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9267 -1.1826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9863 -0.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9863 -0.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9542 -1.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9542 -1.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6368 -0.9652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6368 -0.9652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6600 -1.8319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6600 -1.8319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8601 -2.3908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8601 -2.3908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5043 -2.5834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5043 -2.5834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3298 -3.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3298 -3.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9408 -3.9441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9408 -3.9441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7264 -3.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7264 -3.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9009 -2.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9009 -2.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2899 -2.3314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2899 -2.3314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1424 -4.0693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1424 -4.0693 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 |
| − | 16 21 1 0 0 0 0 | + | 16 21 1 0 0 0 0 |
| − | 22 23 2 0 0 0 0 | + | 22 23 2 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | 24 25 2 0 0 0 0 | + | 24 25 2 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 2 0 0 0 0 | + | 26 27 2 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 29 2 0 0 0 0 | + | 28 29 2 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 30 31 2 0 0 0 0 | + | 30 31 2 0 0 0 0 |
| − | 31 26 1 0 0 0 0 | + | 31 26 1 0 0 0 0 |
| − | 29 32 1 0 0 0 0 | + | 29 32 1 0 0 0 0 |
| − | 33 34 1 0 0 0 0 | + | 33 34 1 0 0 0 0 |
| − | 34 35 1 1 0 0 0 | + | 34 35 1 1 0 0 0 |
| − | 36 35 1 1 0 0 0 | + | 36 35 1 1 0 0 0 |
| − | 37 36 1 1 0 0 0 | + | 37 36 1 1 0 0 0 |
| − | 37 38 1 0 0 0 0 | + | 37 38 1 0 0 0 0 |
| − | 38 33 1 0 0 0 0 | + | 38 33 1 0 0 0 0 |
| − | 36 39 1 0 0 0 0 | + | 36 39 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 |
| − | 33 42 1 0 0 0 0 | + | 33 42 1 0 0 0 0 |
| − | 37 19 1 0 0 0 0 | + | 37 19 1 0 0 0 0 |
| − | 43 44 2 0 0 0 0 | + | 43 44 2 0 0 0 0 |
| − | 43 45 1 0 0 0 0 | + | 43 45 1 0 0 0 0 |
| − | 45 46 2 0 0 0 0 | + | 45 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 |
| − | 43 39 1 0 0 0 0 | + | 43 39 1 0 0 0 0 |
| − | 22 41 1 0 0 0 0 | + | 22 41 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FAAGS0108 | + | ID FL5FAAGS0108 |
| − | FORMULA C39H32O14 | + | FORMULA C39H32O14 |
| − | EXACTMASS 724.179205732 | + | EXACTMASS 724.179205732 |
| − | AVERAGEMASS 724.6629800000001 | + | AVERAGEMASS 724.6629800000001 |
| − | SMILES c(c6)(ccc(c6)O)C=CC(OC(C(O)4)C(OC(C)C4OC(C=Cc(c5)ccc(O)c5)=O)OC(=C1c(c3)ccc(O)c3)C(=O)c(c2O)c(cc(c2)O)O1)=O | + | SMILES c(c6)(ccc(c6)O)C=CC(OC(C(O)4)C(OC(C)C4OC(C=Cc(c5)ccc(O)c5)=O)OC(=C1c(c3)ccc(O)c3)C(=O)c(c2O)c(cc(c2)O)O1)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
0.1446 3.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1446 2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8591 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5737 2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5737 3.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8591 4.0693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5699 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2843 2.8318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9989 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9989 1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2843 1.1817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5699 1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7134 2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4278 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4278 1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7134 1.1817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2843 0.4635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1424 2.8318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0365 1.2442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1744 4.0036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7134 0.4822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9582 -1.9286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2696 -2.1560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5730 -2.2381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1479 -2.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4889 -1.5147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0842 -0.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5045 -0.0858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3295 -0.0948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7342 -0.8138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3139 -1.5237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6156 0.3884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5217 -0.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4105 -1.1124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0781 -0.4475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8372 -0.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7260 0.6933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2375 0.0284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3466 -0.6817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0824 -1.2713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9267 -1.1826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9863 -0.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9542 -1.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6368 -0.9652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6600 -1.8319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8601 -2.3908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5043 -2.5834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3298 -3.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9408 -3.9441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7264 -3.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9009 -2.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2899 -2.3314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1424 -4.0693 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
16 21 1 0 0 0 0
22 23 2 0 0 0 0
22 24 1 0 0 0 0
24 25 2 0 0 0 0
25 26 1 0 0 0 0
26 27 2 0 0 0 0
27 28 1 0 0 0 0
28 29 2 0 0 0 0
29 30 1 0 0 0 0
30 31 2 0 0 0 0
31 26 1 0 0 0 0
29 32 1 0 0 0 0
33 34 1 0 0 0 0
34 35 1 1 0 0 0
36 35 1 1 0 0 0
37 36 1 1 0 0 0
37 38 1 0 0 0 0
38 33 1 0 0 0 0
36 39 1 0 0 0 0
35 40 1 0 0 0 0
34 41 1 0 0 0 0
33 42 1 0 0 0 0
37 19 1 0 0 0 0
43 44 2 0 0 0 0
43 45 1 0 0 0 0
45 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
43 39 1 0 0 0 0
22 41 1 0 0 0 0
S SKP 5
ID FL5FAAGS0108
FORMULA C39H32O14
EXACTMASS 724.179205732
AVERAGEMASS 724.6629800000001
SMILES c(c6)(ccc(c6)O)C=CC(OC(C(O)4)C(OC(C)C4OC(C=Cc(c5)ccc(O)c5)=O)OC(=C1c(c3)ccc(O)c3)C(=O)c(c2O)c(cc(c2)O)O1)=O
M END
