LMPK12110232 LIPID_MAPS_STRUCTURE_DATABASE 51 55 0 0 0 0 0 0 0 0999 V2000 13.4268 8.8072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4268 7.7858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3114 7.2751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1959 7.7858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1959 8.8072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3114 9.3178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0803 7.2751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9648 7.7858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9648 8.8072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0803 9.3178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0803 6.4786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8490 9.3175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7506 8.7972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6521 9.3175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6521 10.3584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7506 10.8791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8490 10.3584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5534 10.8790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3114 6.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5427 9.3175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1932 13.1249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.2632 13.6619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3336 13.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4038 13.6619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4763 13.1263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5504 13.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2683 14.5770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4056 14.6690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4056 12.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5504 14.6426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5670 5.8855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9547 4.7566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1761 5.5887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6973 7.6974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5919 7.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6777 6.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8688 5.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9796 6.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8939 7.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0046 7.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5716 10.2028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5717 12.1710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2734 13.1506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1282 10.6951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8016 13.1345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2746 10.2006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4225 10.6925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4238 11.6791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2747 12.1688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1268 11.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9777 12.1666 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 15 18 1 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 22 27 2 0 0 0 0 24 28 1 0 0 0 0 24 29 1 0 0 0 0 26 30 2 0 0 0 0 39 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 0 0 0 38 39 1 0 0 0 39 40 1 6 0 0 36 31 1 6 0 0 37 32 1 6 0 0 38 33 1 1 0 0 35 2 1 1 0 0 45 51 1 0 0 0 50 44 1 0 0 0 44 46 1 0 0 0 46 47 1 0 0 0 47 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 50 51 1 1 0 0 47 41 1 6 0 0 48 42 1 1 0 0 49 43 1 6 0 0 26 45 1 0 0 0 0 46 6 1 1 0 0 M END > LMPK12110232 > 6'''-(3-Hydroxy-3-methylglutaroyl)isoviolanthin > 5,7,4'-Trihydroxyflavone 6-C-rhamnoside-8-C-[6"'-(3-hydroxy-3-methylglutaroyl)glucoside] > C33H38O18 > 722.21 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > HJERPRJJPPOOLZ-IUVMVBMLSA-N > InChI=1S/C33H38O18/c1-11-22(39)26(43)28(45)31(49-11)20-24(41)19-14(35)7-15(12-3-5-13(34)6-4-12)50-30(19)21(25(20)42)32-29(46)27(44)23(40)16(51-32)10-48-18(38)9-33(2,47)8-17(36)37/h3-7,11,16,22-23,26-29,31-32,34,39-47H,8-10H2,1-2H3,(H,36,37)/t11-,16+,22-,23+,26+,27-,28+,29+,31-,32-,33?/m0/s1 > C1(O)=C([C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(=O)CC(C)(O)CC(=O)O)O2)C2OC(C3C=CC(O)=CC=3)=CC(=O)C=2C(O)=C1[C@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O1 > - > - > - > - > - > - > 127043393 > - > - > - > - > - > 33090; 372983 > - $$$$