LMPK12111199 LIPID_MAPS_STRUCTURE_DATABASE 45 49 0 0 0 999 V2000 12.7748 11.0556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7748 10.1439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5064 9.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2379 10.1439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2379 10.9886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5064 11.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9695 9.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7011 10.1439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7011 10.9886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9695 11.4111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9695 8.9782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4323 11.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1780 10.9806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9236 11.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9236 12.2718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1780 12.7023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4323 12.2718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5064 8.8786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9398 11.7661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6566 12.6951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9918 9.6919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1780 13.3899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8218 13.7616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2000 9.8888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1922 9.5495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8993 11.1165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2570 12.4120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6524 12.6783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9086 11.6265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5536 10.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5470 10.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9007 11.2871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2557 12.2412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6092 13.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4976 8.3199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7876 6.4114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7841 6.0753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8410 8.7647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3081 6.6423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8471 8.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4960 8.1519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1388 7.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1370 7.0277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4882 7.8122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4864 7.6442 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 3 18 1 0 0 0 0 1 19 1 0 0 0 0 20 15 1 0 0 0 0 21 2 1 0 0 0 0 16 22 1 0 0 0 0 22 23 1 0 0 0 0 28 34 1 0 0 0 33 27 1 0 0 0 27 29 1 0 0 0 29 30 1 0 0 0 30 31 1 0 0 0 31 32 1 0 0 0 32 33 1 0 0 0 33 34 1 1 0 0 30 24 1 6 0 0 31 25 1 1 0 0 32 26 1 6 0 0 39 45 1 0 0 0 44 38 1 0 0 0 38 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 0 0 0 44 45 1 1 0 0 40 24 1 1 0 0 41 35 1 6 0 0 42 36 1 1 0 0 43 37 1 6 0 0 29 19 1 1 0 0 M END > LMPK12111199 > 6-Hydroxyluteolin 3'-methyl ether 7-sophoroside > > C28H32O17 > 640.16 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > YPYVYQJEYDRCKV-JFECCKQBSA-N > InChI=1S/C28H32O17/c1-40-13-4-9(2-3-10(13)31)12-5-11(32)18-14(41-12)6-15(19(33)22(18)36)42-28-26(24(38)21(35)17(8-30)44-28)45-27-25(39)23(37)20(34)16(7-29)43-27/h2-6,16-17,20-21,23-31,33-39H,7-8H2,1H3/t16-,17-,20-,21-,23+,24+,25-,26-,27+,28-/m1/s1 > C1(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)[C@@H](O)[C@H](O)[C@@H](CO)O2)=CC2OC(C3C=C(OC)C(O)=CC=3)=CC(=O)C=2C(O)=C1O > - > - > - > - > - > - > 59991325 > - > - > - > - > - > 33090 > - $$$$