LMPK12112159 LIPID_MAPS_STRUCTURE_DATABASE 67 73 0 0 0 999 V2000 2.0433 5.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0433 3.9942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9675 3.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8916 3.9942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8916 5.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9675 5.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8158 3.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 3.9942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 5.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8158 5.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8158 2.6286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6638 5.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6055 5.0508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5475 5.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5475 6.6823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6055 7.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6638 6.6823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1195 5.5947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4891 7.2261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3945 3.3481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9675 2.3939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6055 8.3136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5266 3.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0516 4.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3989 3.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7761 3.8902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5298 3.8902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9830 3.1052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8893 3.1052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3426 3.8902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8893 4.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9830 4.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2471 3.8902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6208 4.6063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3471 5.6194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3305 7.6164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2633 7.1022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5297 8.9485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2577 6.0989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6124 5.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4771 6.1137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4687 7.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5986 7.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5902 8.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9250 1.9515 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5573 -0.0512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6425 -0.7301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2316 1.9285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0905 -0.4281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1925 2.2722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9677 1.6122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7820 0.6085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8248 0.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0496 0.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0921 0.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8432 2.6344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3937 1.3145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0244 -0.6831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5166 0.2902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9867 -1.8763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6993 1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6585 1.6357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4348 0.9729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2500 -0.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2910 -0.3671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1062 -1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3893 2.2392 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 3 4 1 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 1 18 1 0 0 0 0 15 19 1 0 0 0 0 8 20 1 0 0 0 0 3 21 1 0 0 0 0 16 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 38 44 1 0 0 0 43 37 1 0 0 0 37 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 0 0 0 43 44 1 1 0 0 39 18 1 1 0 0 40 34 1 6 0 0 41 35 1 1 0 0 42 36 1 6 0 0 49 55 1 0 0 0 54 48 1 0 0 0 48 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 1 0 0 51 45 1 6 0 0 52 46 1 1 0 0 53 47 1 6 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 45 1 1 0 0 62 56 1 6 0 0 63 57 1 1 0 0 64 58 1 6 0 0 50 20 1 1 0 0 23 56 1 0 0 0 0 29 67 1 0 0 0 M END > LMPK12112159 > Quercetin 3-(2'''-(E)-caffeylsophoroside]-7-glucoside > > C42H46O25 > 950.23 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > - > - > - > - > - > - > - > - > FL5FACGL0074 > 101712270 > - > - > Active > - > https://lipidmaps.org/databases/lmsd/LMPK12112159 $$$$