Mol:FL5FAAGL0025
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 |
− | -3.1396 2.6883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1396 2.6883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.1396 1.8787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1396 1.8787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4385 1.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4385 1.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7374 1.8787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7374 1.8787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7374 2.6883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7374 2.6883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4385 3.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4385 3.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0363 1.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0363 1.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3352 1.8787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3352 1.8787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3352 2.6883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3352 2.6883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0363 3.0931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0363 3.0931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0363 0.8427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0363 0.8427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3657 3.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3657 3.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0803 2.6804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0803 2.6804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.7948 3.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7948 3.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.7948 3.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7948 3.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0803 4.3306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0803 4.3306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.3657 3.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3657 3.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4385 0.6646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4385 0.6646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.8405 3.0929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8405 3.0929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5092 4.3305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5092 4.3305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4312 1.4491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4312 1.4491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5135 0.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5135 0.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.3054 0.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3054 0.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.4184 0.7795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4184 0.7795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.7781 1.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7781 1.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.9863 0.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9863 0.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.8732 0.7601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8732 0.7601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.2083 1.0318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2083 1.0318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.8405 0.1255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8405 0.1255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0476 1.6245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0476 1.6245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.2945 -0.1089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2945 -0.1089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.7259 -0.7426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7259 -0.7426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.1802 -1.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1802 -1.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.7571 -2.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7571 -2.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.5707 -1.9717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5707 -1.9717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.3892 -2.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3892 -2.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.8125 -1.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8125 -1.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.9988 -1.7039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9988 -1.7039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4577 -1.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4577 -1.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.1680 -2.1431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1680 -2.1431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.1021 -2.6066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1021 -2.6066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.3892 -2.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3892 -2.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2983 -2.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2983 -2.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.7214 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7214 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.0922 -3.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0922 -3.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.9108 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9108 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3340 -2.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3340 -2.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.5202 -3.1163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5202 -3.1163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.9589 -3.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9589 -3.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2476 -3.4973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2476 -3.4973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.3983 -4.0177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3983 -4.0177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.9108 -4.3306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9108 -4.3306 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 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 |
− | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
− | 15 20 1 0 0 0 0 | + | 15 20 1 0 0 0 0 |
− | 8 21 1 0 0 0 0 | + | 8 21 1 0 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 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
− | 26 27 1 1 0 0 0 | + | 26 27 1 1 0 0 0 |
− | 27 22 1 1 0 0 0 | + | 27 22 1 1 0 0 0 |
− | 24 28 1 0 0 0 0 | + | 24 28 1 0 0 0 0 |
− | 23 29 1 0 0 0 0 | + | 23 29 1 0 0 0 0 |
− | 26 21 1 0 0 0 0 | + | 26 21 1 0 0 0 0 |
− | 25 30 1 0 0 0 0 | + | 25 30 1 0 0 0 0 |
− | 22 31 1 0 0 0 0 | + | 22 31 1 0 0 0 0 |
− | 31 32 1 0 0 0 0 | + | 31 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 |
− | 35 36 1 1 0 0 0 | + | 35 36 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 |
− | 33 39 1 0 0 0 0 | + | 33 39 1 0 0 0 0 |
− | 34 40 1 0 0 0 0 | + | 34 40 1 0 0 0 0 |
− | 35 41 1 0 0 0 0 | + | 35 41 1 0 0 0 0 |
− | 36 42 1 0 0 0 0 | + | 36 42 1 0 0 0 0 |
− | 37 32 1 0 0 0 0 | + | 37 32 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 |
− | 45 46 1 1 0 0 0 | + | 45 46 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 |
− | 43 49 1 0 0 0 0 | + | 43 49 1 0 0 0 0 |
− | 44 50 1 0 0 0 0 | + | 44 50 1 0 0 0 0 |
− | 45 51 1 0 0 0 0 | + | 45 51 1 0 0 0 0 |
− | 46 52 1 0 0 0 0 | + | 46 52 1 0 0 0 0 |
− | 47 40 1 0 0 0 0 | + | 47 40 1 0 0 0 0 |
− | S SKP 5 | + | S SKP 5 |
− | ID FL5FAAGL0025 | + | ID FL5FAAGL0025 |
− | FORMULA C33H40O19 | + | FORMULA C33H40O19 |
− | EXACTMASS 740.216379098 | + | EXACTMASS 740.216379098 |
− | AVERAGEMASS 740.6593 | + | AVERAGEMASS 740.6593 |
− | SMILES O(CC(O3)C(C(C(O)C3OC(C5=O)=C(Oc(c6)c5c(O)cc6O)c(c4)ccc(O)c4)O)O)C(O1)C(O)C(C(OC(O2)C(C(C(C(C)2)O)O)O)C1C)O | + | SMILES O(CC(O3)C(C(C(O)C3OC(C5=O)=C(Oc(c6)c5c(O)cc6O)c(c4)ccc(O)c4)O)O)C(O1)C(O)C(C(OC(O2)C(C(C(C(C)2)O)O)O)C1C)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 -3.1396 2.6883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1396 1.8787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4385 1.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7374 1.8787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7374 2.6883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4385 3.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 1.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3352 1.8787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3352 2.6883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 3.0931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 0.8427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3657 3.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0803 2.6804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7948 3.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7948 3.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0803 4.3306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3657 3.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4385 0.6646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8405 3.0929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5092 4.3305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4312 1.4491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5135 0.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3054 0.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4184 0.7795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7781 1.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9863 0.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8732 0.7601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2083 1.0318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8405 0.1255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0476 1.6245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2945 -0.1089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7259 -0.7426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1802 -1.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7571 -2.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5707 -1.9717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3892 -2.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8125 -1.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9988 -1.7039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4577 -1.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -2.1431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1021 -2.6066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3892 -2.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2983 -2.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7214 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0922 -3.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9108 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -2.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5202 -3.1163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9589 -3.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2476 -3.4973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3983 -4.0177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9108 -4.3306 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 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 1 19 1 0 0 0 0 15 20 1 0 0 0 0 8 21 1 0 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 26 1 0 0 0 0 26 27 1 1 0 0 0 27 22 1 1 0 0 0 24 28 1 0 0 0 0 23 29 1 0 0 0 0 26 21 1 0 0 0 0 25 30 1 0 0 0 0 22 31 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 1 0 0 0 35 36 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 33 39 1 0 0 0 0 34 40 1 0 0 0 0 35 41 1 0 0 0 0 36 42 1 0 0 0 0 37 32 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 1 0 0 0 45 46 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 43 49 1 0 0 0 0 44 50 1 0 0 0 0 45 51 1 0 0 0 0 46 52 1 0 0 0 0 47 40 1 0 0 0 0 S SKP 5 ID FL5FAAGL0025 FORMULA C33H40O19 EXACTMASS 740.216379098 AVERAGEMASS 740.6593 SMILES O(CC(O3)C(C(C(O)C3OC(C5=O)=C(Oc(c6)c5c(O)cc6O)c(c4)ccc(O)c4)O)O)C(O1)C(O)C(C(OC(O2)C(C(C(C(C)2)O)O)O)C1C)O M END