LMPK12111943 LIPID_MAPS_STRUCTURE_DATABASE 53 58 0 0 0 999 V2000 12.2571 16.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2571 15.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1778 14.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0988 15.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0988 16.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1778 16.7639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3364 14.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4158 15.1691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4949 14.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4949 13.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4158 13.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3364 13.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5741 15.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6535 14.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6535 13.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5741 13.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4158 12.1172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 15.1691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1178 13.1233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8729 16.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5741 12.1414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3045 8.3249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2375 8.2715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6424 7.7346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8776 7.7262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2610 8.3296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5251 9.3594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7650 10.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7411 9.8166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4772 8.7866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2371 8.0432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2239 10.3226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5724 11.6899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0542 9.7564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1247 9.2419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9313 11.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9000 12.1402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6076 11.4327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3466 10.4639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3819 10.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6743 10.9143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7095 10.6571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3066 11.0024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1863 11.3174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9275 10.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1853 9.4802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0155 9.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7906 8.1929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5780 7.4786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5904 7.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8152 8.8425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0278 9.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1264 7.3173 0.0000 O 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 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 38 33 1 6 0 0 39 34 1 6 0 0 40 35 1 1 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 45 46 2 0 0 0 0 46 47 1 0 0 0 0 47 48 2 0 0 0 0 48 49 1 0 0 0 0 49 50 2 0 0 0 0 50 51 1 0 0 0 0 51 52 2 0 0 0 0 52 47 1 0 0 0 0 50 53 1 0 0 0 0 43 33 1 0 0 0 0 22 35 1 0 0 0 0 37 19 1 1 0 0 M END > LMPK12111943 > Kaempferol 3-(2'',4''-di-(Z)-p-coumaroylrhamnoside) > > C39H32O14 > 724.18 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > KMOHJUXDKSMQOG-CPUVFPGGSA-N > InChI=1S/C39H32O14/c1-20-35(51-30(45)16-6-21-2-10-24(40)11-3-21)34(48)38(52-31(46)17-7-22-4-12-25(41)13-5-22)39(49-20)53-37-33(47)32-28(44)18-27(43)19-29(32)50-36(37)23-8-14-26(42)15-9-23/h2-20,34-35,38-44,48H,1H3/b16-6-,17-7-/t20-,34+,35-,38+,39-/m0/s1 > C1C=C(O)C=CC=1C1=C(O[C@H]2[C@H](OC(/C=C\C3C=CC(O)=CC=3)=O)[C@H](O)[C@@H](OC(/C=C\C3C=CC(O)=CC=3)=O)[C@H](C)O2)C(=O)C2C(O)=CC(O)=CC=2O1 > - > - > - > - > - > - > 49822436 > - > - > - > - > - > 33090 > - $$$$