LMPK12050438 LIPID_MAPS_STRUCTURE_DATABASE 49 53 0 0 0 999 V2000 14.7721 11.0301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7033 10.4926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6345 11.0301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5652 10.4929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5652 9.3781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5305 8.8209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4958 9.3781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4958 10.4929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5305 11.0504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7037 9.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6345 8.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5305 7.7552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4187 8.8454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4187 7.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3415 7.2470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2643 7.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2643 8.8454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3415 9.3781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6345 7.8151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6121 11.8072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.3639 6.3367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.3504 10.1433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.1871 7.2469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3938 12.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9873 10.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9524 7.6888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1077 5.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7583 9.0794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0617 8.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3842 9.1032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0824 11.0421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6501 10.4283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9265 10.5484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9196 9.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0686 9.0912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2299 9.5849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2369 10.5602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3980 11.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9751 8.5049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4717 7.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6482 7.9424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9838 10.1467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6951 9.1199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9008 9.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0634 8.8454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3090 8.2231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3974 8.5636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2349 9.5254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3230 9.8658 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 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 4 1 0 0 0 0 2 10 1 0 0 0 0 10 11 2 0 0 0 0 11 5 1 0 0 0 0 6 12 2 0 0 0 0 7 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 17 1 0 0 0 0 17 18 2 0 0 0 0 18 13 1 0 0 0 0 11 19 1 0 0 0 0 3 20 1 0 0 0 0 15 21 1 0 0 0 0 18 22 1 0 0 0 0 16 23 1 0 0 0 0 20 24 1 0 0 0 0 22 25 1 0 0 0 0 23 26 1 0 0 0 0 21 27 1 0 0 0 0 32 38 1 0 0 0 37 31 1 0 0 0 31 33 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 37 38 1 1 0 0 33 1 1 1 0 0 34 28 1 6 0 0 35 29 1 1 0 0 36 30 1 6 0 0 43 49 1 0 0 0 48 42 1 0 0 0 42 44 1 0 0 0 44 45 1 0 0 0 45 46 1 0 0 0 46 47 1 0 0 0 47 48 1 0 0 0 48 49 1 1 0 0 44 32 1 1 0 0 45 39 1 6 0 0 46 40 1 1 0 0 47 41 1 6 0 0 M END > LMPK12050438 > Isocaviunin 7-O-gentiobioside > 5,7-Dihydroxy-8,2',4',5'-tetramethoxyisoflavone 7-O-glucosyl-(1->6)-glucoside > C31H38O18 > 698.21 > Polyketides [PK] > Flavonoids [PK12] > Isoflavonoids [PK1205] > - > > GDKJKYQGMIFYJT-FGJBEURYSA-N > InChI=1S/C31H38O18/c1-41-14-7-16(43-3)15(42-2)5-11(14)12-9-45-29-20(21(12)34)13(33)6-17(28(29)44-4)47-31-27(40)25(38)23(36)19(49-31)10-46-30-26(39)24(37)22(35)18(8-32)48-30/h5-7,9,18-19,22-27,30-33,35-40H,8,10H2,1-4H3/t18-,19-,22-,23-,24+,25+,26-,27-,30-,31-/m1/s1 > O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)O1)C1C=C(O)C2C(=O)C(C3C(OC)=CC(OC)=C(OC)C=3)=COC=2C=1OC > - > - > - > - > - > - > 102077547 > - > - > - > - > - > 33090; 107308 > - $$$$