LMPK12111959 LIPID_MAPS_STRUCTURE_DATABASE 48 52 0 0 0 999 V2000 15.4970 15.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4970 13.9968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4304 13.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3639 13.9968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3639 15.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4304 15.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5633 13.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6299 13.9968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6964 13.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6964 12.3798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6299 11.8409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5633 12.3798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7627 13.9968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8293 13.4579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8293 12.3798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7627 11.8409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6299 10.9024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8682 13.9338 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3557 11.9224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1489 15.5278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7627 10.9270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6796 11.9413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8595 11.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2333 12.2673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1422 14.0971 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9608 13.5170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8665 12.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9537 12.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1407 12.6840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2350 13.6802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4218 14.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1961 11.0530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3705 9.0589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7333 7.9155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6496 10.3275 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1837 7.7963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4706 10.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3775 10.4813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4636 9.4817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6449 8.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7381 9.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9194 8.7613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4401 7.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4401 6.4452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6314 7.6443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3287 7.1898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1661 7.2630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0420 6.3528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 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 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 12 19 1 0 0 0 0 5 20 1 0 0 0 0 16 21 1 0 0 0 0 30 25 1 0 0 0 25 26 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 1 6 0 0 26 18 1 1 0 0 27 22 1 6 0 0 28 23 1 6 0 0 29 24 1 1 0 0 36 42 1 0 0 0 41 35 1 0 0 0 35 37 1 0 0 0 37 38 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 41 1 0 0 0 41 42 1 1 0 0 38 32 1 6 0 0 39 33 1 6 0 0 40 34 1 1 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 36 43 1 0 0 0 0 46 47 2 0 0 0 0 46 48 1 0 0 0 0 37 19 1 1 0 0 34 46 1 0 0 0 0 M END > LMPK12111959 > Kaempferol 3-(4'',6''-diacetylglucoside)-7-rhamnoside > > C31H34O17 > 678.18 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > HBNFLLJEFIGGHR-FIXXFGJNSA-N > InChI=1S/C31H34O17/c1-11-21(36)23(38)25(40)30(43-11)45-16-8-17(35)20-18(9-16)46-27(14-4-6-15(34)7-5-14)29(22(20)37)48-31-26(41)24(39)28(44-13(3)33)19(47-31)10-42-12(2)32/h4-9,11,19,21,23-26,28,30-31,34-36,38-41H,10H2,1-3H3/t11-,19+,21-,23+,24-,25+,26+,28-,30-,31-/m0/s1 > C1C=C(O)C=CC=1C1=C(O[C@H]2[C@H](O)[C@H](O)[C@@H](OC(C)=O)[C@@H](COC(C)=O)O2)C(=O)C2C(O)=CC(O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)=CC=2O1 > - > - > - > - > - > - > 44259029 > - > - > - > - > - > 33090 > - $$$$