LMPK12111892 LIPID_MAPS_STRUCTURE_DATABASE 53 58 0 0 0 999 V2000 7.5166 13.6973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5166 12.6800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3976 12.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2787 12.6800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2787 13.6973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3976 14.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1596 12.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0406 12.6800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0406 13.6973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1596 14.2061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1596 11.3782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1499 14.4018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0479 13.8835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9458 14.4018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9458 15.4387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0479 15.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1499 15.4387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3976 11.1544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2029 16.0394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 14.2061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9327 12.0315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1990 11.5276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7604 12.3217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8231 13.4382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3391 14.2765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7899 13.4382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2531 14.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2709 14.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7162 15.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6069 15.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0522 14.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6069 13.4689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7162 13.4689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9430 14.2404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1102 11.4479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6219 12.1788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4802 12.1037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8278 11.3586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6467 11.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1182 11.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7708 12.7054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9519 12.7771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9361 11.8889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4750 13.3071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3510 12.6091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6814 10.6396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0377 10.6956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8690 11.6846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6401 12.3223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5800 11.9712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7451 10.9866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9740 10.3488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1391 9.3640 0.0000 C 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 4 3 1 0 0 0 0 22 23 2 0 0 0 0 24 25 2 0 0 0 0 24 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 32 1 0 0 0 0 32 33 2 0 0 0 0 33 28 1 0 0 0 0 31 34 1 0 0 0 0 22 35 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 42 37 1 0 0 0 0 40 43 1 0 0 0 0 52 47 1 0 0 0 47 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 6 0 0 48 21 1 1 0 0 49 44 1 6 0 0 50 45 1 6 0 0 51 46 1 1 0 0 45 24 1 0 0 0 0 46 22 1 0 0 0 0 M END > LMPK12111892 > Kaempferol 3-(3'',4''-di-p-coumarylrhamnoside) > > C39H32O14 > 724.18 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > RMHWAEFAOBGGBH-GLRBGJJXSA-N > InChI=1S/C39H32O14/c1-20-35(51-30(45)16-6-21-2-10-24(40)11-3-21)38(52-31(46)17-7-22-4-12-25(41)13-5-22)34(48)39(49-20)53-37-33(47)32-28(44)18-27(43)19-29(32)50-36(37)23-8-14-26(42)15-9-23/h2-20,34-35,38-44,48H,1H3/b16-6+,17-7+/t20-,34+,35-,38-,39-/m0/s1 > C1(O)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](O)[C@H](OC(/C=C/C4C=CC(O)=CC=4)=O)[C@@H](OC(/C=C/C4C=CC(O)=CC=4)=O)[C@H](C)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 51136469 > - > - > - > - > - > 33090 > - $$$$