LMPK12111799 LIPID_MAPS_STRUCTURE_DATABASE 60 65 0 0 0 999 V2000 7.4794 15.9076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4794 14.9384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3188 14.4537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1581 14.9384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1581 15.9076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3188 16.3924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9975 14.4537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8369 14.9384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8369 15.9076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9975 16.3924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9975 13.6979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8939 16.5788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7495 16.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6050 16.5788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6050 17.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7495 18.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8939 17.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3188 13.4850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4279 18.0418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 16.3924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3512 11.1837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8940 10.2437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2721 11.1837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 10.2494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7299 10.2494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2908 11.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4126 11.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9735 10.2494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4126 9.4889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2908 9.4889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 10.2494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6062 14.3577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3395 13.3569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3394 11.3553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6087 10.3589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7393 12.8562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6075 13.3591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4741 12.8588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4727 11.8555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6074 11.3574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7408 11.8577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8754 11.3596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2308 14.1543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5711 14.8141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1534 14.1543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7142 15.1256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4911 15.1256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9683 14.2993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9225 14.2993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3996 15.1256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9225 15.9521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9683 15.9521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3518 15.1256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3982 11.9034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1572 12.8026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0917 11.5030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 8.8529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9233 9.4534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6168 9.0530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9682 11.7803 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 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 24 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 25 1 0 0 0 0 28 31 1 0 0 0 0 4 3 1 0 0 0 0 41 36 1 0 0 0 36 37 1 0 0 0 37 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 1 0 0 37 32 1 1 0 0 38 33 1 6 0 0 39 34 1 1 0 0 40 35 1 6 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 33 43 1 0 0 0 0 54 55 1 0 0 0 0 54 56 2 0 0 0 0 34 54 1 0 0 0 0 57 58 1 0 0 0 0 58 59 2 0 0 0 0 58 35 1 0 0 0 0 42 60 1 0 0 0 21 60 1 0 0 0 0 32 8 1 0 0 0 0 M END > LMPK12111799 > Kaempferol 3-(3'',4''-diacetyl-2'',6''-di-(E)-p-coumarylglucoside) > > C43H36O17 > 824.20 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > IFLHDGGEJKVLAF-FEMPFSAESA-N > InChI=1S/C43H36O17/c1-22(44)55-39-33(21-54-34(51)17-7-24-3-11-27(46)12-4-24)58-43(42(41(39)56-23(2)45)59-35(52)18-8-25-5-13-28(47)14-6-25)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(/C=C/C4C=CC(O)=CC=4)=O)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@H](COC(/C=C/C4C=CC(O)=CC=4)=O)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 10328097 > - > - > - > - > - > 33090 > - $$$$