LMPK12111798 LIPID_MAPS_STRUCTURE_DATABASE 60 65 0 0 0 999 V2000 7.4862 17.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4862 16.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3335 15.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1804 16.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1804 17.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3335 17.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0275 15.8909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8745 16.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8745 17.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0275 17.8471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0275 15.1281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9412 18.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8046 17.5370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6680 18.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6680 19.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8046 19.5310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9412 19.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3335 14.9132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8764 19.6099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 17.8471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8097 15.6427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9001 10.8587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4479 9.9099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8113 10.8587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2668 9.9155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2548 9.9155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8118 10.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9255 10.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4822 9.9155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9255 9.1482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8118 9.1482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5966 9.9155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8003 15.6679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8011 13.9343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8005 12.2061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7989 13.9342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4463 11.4432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2993 14.8038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2999 14.8038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8005 13.9342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3001 13.0702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2994 13.0702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7990 12.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8694 11.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7197 12.0994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4549 11.6749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4549 10.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7127 10.0436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7127 9.1868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4549 8.7583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1969 9.1868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1969 10.0436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4549 7.9019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8694 11.0374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8747 14.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6317 15.3873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5747 14.0757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7997 16.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5567 17.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4997 15.8007 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 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 19 15 1 0 0 0 0 20 1 1 0 0 0 0 21 8 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 4 3 1 0 0 0 0 37 43 1 0 0 0 42 36 1 0 0 0 36 38 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 41 1 0 0 0 41 42 1 0 0 0 42 43 1 1 0 0 39 33 1 6 0 0 40 34 1 1 0 0 41 35 1 6 0 0 44 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 44 54 2 0 0 0 0 35 44 1 0 0 0 0 55 56 1 0 0 0 0 55 57 2 0 0 0 0 34 55 1 0 0 0 0 58 59 1 0 0 0 0 58 60 2 0 0 0 0 33 58 1 0 0 0 0 22 37 1 0 0 0 0 38 21 1 1 0 0 M END > LMPK12111798 > Kaempferol 3-(2'',3''-diacetyl-4''-(Z)-p-coumaryl-6''-(E)-p-coumarylglucoside) > > C43H36O17 > 824.20 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > QFYWXPXFEBIELC-ASZZAFOJSA-N > InChI=1S/C43H36O17/c1-22(44)55-41-39(59-35(52)18-8-25-5-13-28(47)14-6-25)33(21-54-34(51)17-7-24-3-11-27(46)12-4-24)58-43(42(41)56-23(2)45)60-40-37(53)36-31(50)19-30(49)20-32(36)57-38(40)26-9-15-29(48)16-10-26/h3-20,33,39,41-43,46-50H,21H2,1-2H3/b17-7+,18-8-/t33-,39-,41+,42-,43+/m1/s1 > C1(O)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)/C=C\C4C=CC(O)=CC=4)[C@@H](COC(/C=C/C4C=CC(O)=CC=4)=O)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 10418008 > - > - > - > - > - > 33090 > - $$$$