LMPK12110793 LIPID_MAPS_STRUCTURE_DATABASE 59 64 0 0 0 999 V2000 16.7395 15.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7395 14.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6401 14.2324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5405 14.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5405 15.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6401 16.3122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8390 14.2324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9385 14.7524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0379 14.2324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0379 13.1926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9385 12.6727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8390 13.1926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1373 14.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2367 14.2324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2367 13.1926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1373 12.6727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9385 11.7674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3362 14.7524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1373 11.8081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4300 16.2985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5017 14.2030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.3204 14.6756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9375 11.1532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8293 11.6681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9375 10.2295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7555 9.8102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7555 8.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8549 8.3631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8549 7.3232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7555 6.8033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6558 7.3232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6558 8.3631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7555 5.8106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1138 6.8954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1138 6.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7563 13.6082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9422 14.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7706 16.4439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4014 16.1763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4423 17.8455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4902 15.1769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6706 14.6031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7618 15.0282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6761 16.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4958 16.5969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4101 17.5918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1748 18.2361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1207 11.6701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5872 10.3835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7114 11.0688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0658 13.3400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7250 12.2700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0090 12.9982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1827 12.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4133 11.3689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4756 11.7117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3018 12.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3639 13.0398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1031 14.0051 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 16 19 1 0 0 0 0 5 20 1 0 0 0 0 4 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 27 1 0 0 0 0 30 33 1 0 0 0 0 29 34 1 0 0 0 0 34 35 1 0 0 0 0 40 46 1 0 0 0 45 39 1 0 0 0 39 41 1 0 0 0 41 42 1 0 0 0 42 43 1 0 0 0 43 44 1 0 0 0 44 45 1 0 0 0 45 46 1 1 0 0 42 36 1 6 0 0 43 37 1 1 0 0 44 38 1 6 0 0 46 47 2 0 0 0 52 58 1 0 0 0 57 51 1 0 0 0 51 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 0 0 0 56 57 1 0 0 0 57 58 1 1 0 0 54 48 1 6 0 0 55 49 1 1 0 0 56 50 1 6 0 0 58 59 2 0 0 0 53 36 1 1 0 0 41 18 1 1 0 0 48 23 1 0 0 0 0 M END > LMPK12110793 > Chrysoeriol 7-(2'''-feruloylglucuronosyl)-(1->2)-glucuronide > > C38H36O21 > 828.17 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > CQSOKHCNRZFEOH-BWRVQHKVSA-N > InChI=1S/C38H36O21/c1-52-22-9-14(3-6-17(22)39)4-8-25(43)56-33-29(46)27(44)32(36(50)51)58-38(33)59-34-30(47)28(45)31(35(48)49)57-37(34)54-16-11-19(41)26-20(42)13-21(55-24(26)12-16)15-5-7-18(40)23(10-15)53-2/h3-13,27-34,37-41,44-47H,1-2H3,(H,48,49)(H,50,51)/b8-4+/t27-,28-,29-,30-,31-,32-,33+,34+,37+,38-/m0/s1 > C1C=C(O)C(OC)=CC=1C1=CC(=O)C2C(O)=CC(O[C@H]3[C@H](O[C@H]4[C@H](OC(/C=C/C5C=CC(O)=C(OC)C=5)=O)[C@@H](O)[C@H](O)[C@@H](C(=O)O)O4)[C@@H](O)[C@H](O)[C@@H](C(=O)O)O3)=CC=2O1 > - > - > - > - > - > - > 53493979 > - > - > - > - > - > 33090 > - $$$$