LMPK12110783 LIPID_MAPS_STRUCTURE_DATABASE 55 60 0 0 0 999 V2000 12.1227 14.4715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6975 13.0663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7678 13.5982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2670 15.5313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9055 15.7060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6957 17.0253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1597 14.7355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4472 14.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4802 14.3008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2300 15.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9425 15.9699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6922 16.9365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8578 11.0713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2100 9.9349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4072 10.7939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9694 12.9275 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5383 12.0827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8763 12.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9564 11.5009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1297 10.9323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2284 11.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1483 12.3593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2469 12.7889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7336 10.3735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0672 8.3998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5268 7.1289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2534 9.4464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9916 6.8861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0255 10.0870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9634 9.7381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1293 8.7486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3591 8.1133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4212 8.4622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6510 7.8268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9000 14.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7660 13.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7660 12.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9000 12.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0340 12.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0340 13.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6321 14.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4981 13.9751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4981 12.9750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6321 12.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3641 14.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3641 15.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2302 15.9751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0962 15.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0962 14.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2302 13.9751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2302 16.9751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.0962 17.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9622 15.9751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6321 11.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9000 11.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6 12 1 0 0 0 11 5 1 0 0 0 5 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 10 11 1 0 0 0 11 12 1 1 0 0 7 1 1 1 0 0 8 2 1 6 0 0 9 3 1 1 0 0 10 4 1 6 0 0 17 23 1 0 0 0 22 16 1 0 0 0 16 18 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 22 23 1 1 0 0 18 2 1 1 0 0 19 13 1 6 0 0 20 14 1 1 0 0 21 15 1 6 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 29 13 1 1 0 0 30 24 1 6 0 0 31 25 1 1 0 0 32 26 1 6 0 0 35 36 1 0 0 0 36 37 2 0 0 0 37 38 1 0 0 0 38 39 2 0 0 0 39 40 1 0 0 0 40 35 2 0 0 0 36 41 1 0 0 0 41 42 1 0 0 0 42 43 2 0 0 0 43 44 1 0 0 0 44 37 1 0 0 0 42 45 1 0 0 0 45 46 1 0 0 0 46 47 2 0 0 0 47 48 1 0 0 0 48 49 2 0 0 0 49 50 1 0 0 0 50 45 2 0 0 0 47 51 1 0 0 0 51 52 1 0 0 0 48 53 1 0 0 0 44 54 2 0 0 0 38 55 1 0 0 0 40 1 1 0 0 0 M END > LMPK12110783 > Luteolin 3'-methyl ether 7-sophorotrioside > > C34H42O21 > 786.22 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > RTUQRPMCWAPPGZ-MDJGWLLISA-N > InChI=1S/C34H42O21/c1-48-17-4-11(2-3-13(17)38)16-7-15(40)22-14(39)5-12(6-18(22)50-16)49-33-30(27(45)24(42)20(9-36)52-33)55-34-31(28(46)25(43)21(10-37)53-34)54-32-29(47)26(44)23(41)19(8-35)51-32/h2-7,19-21,23-39,41-47H,8-10H2,1H3/t19-,20-,21-,23-,24-,25-,26+,27+,28+,29-,30-,31-,32+,33-,34+/m1/s1 > O(C1=CC2OC(C3=CC=C(O)C(OC)=C3)=CC(=O)C=2C(O)=C1)[C@H]1[C@H](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)[C@@H](O)[C@H](O)[C@@H](CO)O1 > - > - > - > - > - > - > 44258199 > - > - > - > - > - > 33090 > - $$$$