LMPK12112158 LIPID_MAPS_STRUCTURE_DATABASE 66 72 0 0 0 0 0 0 0 0999 V2000 9.4645 13.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4645 12.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3828 12.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3009 12.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3009 13.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3828 14.1554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2191 12.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1373 12.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1373 13.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2191 14.1554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2191 11.2082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0551 14.1551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9907 13.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9266 14.1551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9266 15.2356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9907 15.7760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0551 15.2356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5467 14.1551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8621 15.7759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7876 11.9230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3828 10.9750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9907 16.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8929 11.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4210 12.6303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7596 11.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1343 12.4616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8832 12.4616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3334 11.6817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2339 11.6817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6842 12.4616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2339 13.2413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3334 13.2413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5829 12.4616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8177 13.1731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1026 14.1796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1190 16.1637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6961 15.6528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9147 17.4872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6905 14.6560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 14.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9669 14.6707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9753 15.6627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8397 16.1537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8481 17.1457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3082 10.5355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9428 8.5457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0404 7.8712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6322 10.5126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4985 8.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5869 10.8541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3571 10.1984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1726 9.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2216 8.8641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4514 9.5198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5001 9.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2139 11.2139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7544 9.9026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3875 7.9179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8959 8.8849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3565 6.7324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0774 9.8825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0304 10.2217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8017 9.5632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6181 8.5710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6653 8.2319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4817 7.2394 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 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 M END > LMPK12112158 > Quercetin 3-p-coumarylsophoroside-7-glucoside > 3,5,7,3',4'-Pentahydroxyflavone 3-p-coumarylsophoroside-7-glucoside > C42H46O24 > 934.24 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > DBYRCYCHEZRNKW-MDGSKLIASA-N > InChI=1S/C42H46O24/c43-12-23-28(51)32(55)35(58)40(61-23)59-18-10-21(49)27-22(11-18)60-36(16-4-7-19(47)20(48)9-16)37(31(27)54)65-42-39(34(57)30(53)25(14-45)63-42)66-41-38(33(56)29(52)24(13-44)62-41)64-26(50)8-3-15-1-5-17(46)6-2-15/h1-11,23-25,28-30,32-35,38-49,51-53,55-58H,12-14H2/b8-3+/t23-,24-,25-,28-,29-,30-,32+,33+,34+,35-,38-,39-,40-,41+,42+/m1/s1 > C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=CC2OC(C3C=C(O)C(O)=CC=3)=C(O[C@H]3[C@H](O[C@H]4[C@H](OC(/C=C/C5C=CC(O)=CC=5)=O)[C@@H](O)[C@H](O)[C@@H](CO)O4)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 101712272 > - > - > - > - > - > 33090; 286862 > - $$$$