LMPK12111801 LIPID_MAPS_STRUCTURE_DATABASE 50 54 0 0 0 999 V2000 7.6212 12.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6212 11.2212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5800 10.6675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5389 11.2212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5389 12.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5800 12.8818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4976 10.6675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4565 11.2212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4565 12.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4976 12.8818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4976 9.8045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6638 13.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6408 12.5308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6181 13.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6181 14.2233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6408 14.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6638 14.2233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5800 9.5608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6639 14.8272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 13.1104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5601 11.3799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5753 11.4373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5761 9.7038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5755 7.9756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5739 9.7036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0743 10.5732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0749 10.5732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5755 9.7036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0751 8.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0744 8.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5740 7.9756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5556 6.1906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5538 6.2047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5697 7.9425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0730 8.7941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5700 7.9225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0635 7.0594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0602 7.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5682 7.9366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0746 8.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8401 5.7670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1139 5.9616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6936 4.9359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9477 5.8498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2215 6.0443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8011 5.0186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9198 7.5774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1936 7.7719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7733 6.7462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5780 7.8863 0.0000 O 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 4 3 1 0 0 0 0 1 20 1 0 0 0 0 21 8 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 1 0 0 27 22 1 6 0 0 28 23 1 1 0 0 29 24 1 6 0 0 40 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 0 0 0 37 32 1 6 0 0 38 33 1 1 0 0 39 34 1 1 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 32 41 1 0 0 0 0 44 45 2 0 0 0 0 44 46 1 0 0 0 0 33 44 1 0 0 0 0 47 48 2 0 0 0 0 47 49 1 0 0 0 0 34 47 1 0 0 0 0 26 21 1 1 0 0 31 50 1 0 0 0 36 50 1 1 0 0 M END > LMPK12111801 > Kaempferol 3-[2''',3''',4'''-triacetyl-alpha-L-arabinopyranosyl-(1->6)-glucoside] > > C32H34O18 > 706.17 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > IOLQBAHNCVLDFS-PORTXAGJSA-N > InChI=1S/C32H34O18/c1-12(33)45-21-11-44-32(30(47-14(3)35)28(21)46-13(2)34)43-10-20-23(39)25(41)26(42)31(49-20)50-29-24(40)22-18(38)8-17(37)9-19(22)48-27(29)15-4-6-16(36)7-5-15/h4-9,20-21,23,25-26,28,30-32,36-39,41-42H,10-11H2,1-3H3/t20-,21+,23-,25+,26-,28+,30-,31+,32-/m1/s1 > C1(O)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]4[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)CO4)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 102080059 > - > - > - > - > - > 33090 > - $$$$