LMPK12111890 LIPID_MAPS_STRUCTURE_DATABASE 53 58 0 0 0 999 V2000 7.5002 13.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5002 12.0440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3630 11.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2257 12.0440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2257 13.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3630 13.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0883 11.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9511 12.0440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9511 13.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0883 13.5384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0883 10.7692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0374 13.7300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9168 13.2223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7960 13.7300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7960 14.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9168 15.2529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0374 14.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3630 10.5501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0267 15.3335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 13.5384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8247 11.4089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4981 11.7180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4981 12.3907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4572 11.1641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1800 11.5812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1065 11.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1065 10.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8548 9.7503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6029 10.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6029 11.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8548 11.4782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3509 9.7506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7932 11.0474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4643 9.1616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1680 7.6426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5115 9.7038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1608 10.4687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1449 10.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4801 9.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8319 8.5829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8478 8.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1995 8.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1864 6.5459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7445 8.7924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4468 8.2031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2875 7.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4261 6.9867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7238 7.5760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8829 8.4788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1719 9.0754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3326 8.7700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7830 10.1771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4659 9.4972 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 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 19 15 1 0 0 0 0 20 1 1 0 0 0 0 21 8 1 0 0 0 0 4 3 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 26 1 0 0 0 0 29 32 1 0 0 0 0 41 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 0 0 0 40 41 1 0 0 0 41 42 1 6 0 0 37 21 1 1 0 0 38 33 1 6 0 0 39 34 1 6 0 0 40 35 1 1 0 0 33 22 1 0 0 0 0 46 43 1 0 0 0 0 44 49 1 0 0 0 0 45 44 2 0 0 0 0 46 45 1 0 0 0 0 47 46 2 0 0 0 0 48 47 1 0 0 0 0 49 48 2 0 0 0 0 50 49 1 0 0 0 0 51 50 2 0 0 0 0 53 51 1 0 0 0 0 53 52 2 0 0 0 0 34 53 1 0 0 0 0 M END > LMPK12111890 > Platanoside > > C39H32O14 > 724.18 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > Kaempferol 3-(2'',3''-di-(E)-p-coumaroylrhamnoside) > HKZIBACORRUGAC-FIFPDCARSA-N > InChI=1S/C39H32O14/c1-20-33(47)36(51-30(45)16-6-21-2-10-24(40)11-3-21)38(52-31(46)17-7-22-4-12-25(41)13-5-22)39(49-20)53-37-34(48)32-28(44)18-27(43)19-29(32)50-35(37)23-8-14-26(42)15-9-23/h2-20,33,36,38-44,47H,1H3/b16-6+,17-7+/t20-,33-,36+,38+,39-/m0/s1 > C1(O)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](OC(/C=C/C4C=CC(O)=CC=4)=O)[C@H](OC(=O)/C=C/C4=CC=C(C=C4)O)[C@@H](O)[C@H](C)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 6451113 > - > - > - > - > - > 33090 > - $$$$