LMPK12111961 LIPID_MAPS_STRUCTURE_DATABASE 66 72 0 0 0 999 V2000 12.2429 14.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2429 13.4349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1611 12.9047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0795 13.4349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0795 14.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1611 15.0256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3245 12.9047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4061 13.4349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4876 12.9047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4876 11.8442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4061 11.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3245 11.8442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5695 13.4349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6510 12.9047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6510 11.8442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5695 11.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4061 10.3909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 13.4349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2716 11.3326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8516 14.9412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5695 10.4149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9589 9.9965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4086 9.0900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8070 9.9997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3168 9.0698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3771 9.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8871 8.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9473 8.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4975 9.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9875 9.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9273 9.9531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3782 8.9809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4959 7.2272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.0288 6.3827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8309 13.6269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2647 11.3581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2655 9.6244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2648 7.8963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2633 9.6243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2674 7.8036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7636 10.4940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7644 10.4940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2648 9.6243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7646 8.7603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7638 8.7603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2635 7.8962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1079 6.1723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1150 6.3610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2862 8.1779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8543 8.8081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2731 7.8964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6934 7.0809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6947 7.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2804 8.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8602 8.9006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4458 9.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7963 13.2876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1338 12.3681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9361 10.8975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5095 10.8599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2307 11.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4965 12.5756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4678 12.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1678 12.1152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9020 11.1506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6021 10.4386 0.0000 C 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 12 19 1 0 0 0 0 5 20 1 0 0 0 0 16 21 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 28 33 1 0 0 0 0 33 34 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 1 0 0 55 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 6 0 0 51 40 1 1 0 0 52 47 1 6 0 0 53 48 1 6 0 0 54 49 1 1 0 0 41 19 1 1 0 0 60 66 1 0 0 0 65 59 1 0 0 0 59 61 1 0 0 0 61 62 1 0 0 0 62 63 1 0 0 0 63 64 1 0 0 0 64 65 1 0 0 0 65 66 1 1 0 0 61 36 1 1 0 0 62 57 1 6 0 0 64 58 1 6 0 0 63 35 1 1 0 0 60 22 1 0 0 0 0 M END > LMPK12111961 > Kaempferol 3-[2Gal-(6'''-feruloylglucosyl)-robinobioside] > > C43H48O23 > 932.26 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > RVMHGPXKOGDQJZ-ZKDYLKKZSA-N > InChI=1S/C43H48O23/c1-16-29(49)33(53)36(56)41(61-16)60-15-26-31(51)35(55)40(43(64-26)65-39-32(52)28-22(47)12-20(45)13-24(28)62-38(39)18-5-7-19(44)8-6-18)66-42-37(57)34(54)30(50)25(63-42)14-59-27(48)10-4-17-3-9-21(46)23(11-17)58-2/h3-13,16,25-26,29-31,33-37,40-47,49-51,53-57H,14-15H2,1-2H3/b10-4+/t16-,25+,26+,29-,30+,31-,33+,34-,35-,36+,37+,40+,41+,42-,43-/m0/s1 > C1C=C(O)C=CC=1C1=C(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(/C=C/C4C=CC(O)=C(OC)C=4)=O)O3)[C@@H](O)[C@@H](O)[C@@H](CO[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)O2)C(=O)C2C(O)=CC(O)=CC=2O1 > - > - > - > - > - > - > 44259031 > - > - > - > - > - > 33090 > - $$$$