LMPK12112593 LIPID_MAPS_STRUCTURE_DATABASE 44 48 0 0 0 999 V2000 12.2867 14.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2867 13.0847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1876 12.5645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0885 13.0847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0885 14.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1876 14.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3856 12.5645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4846 13.0847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5837 12.5645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5837 11.5242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4846 11.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3856 11.5242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6827 13.0847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7817 12.5645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7817 11.5242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6827 11.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4846 10.0982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8807 13.0847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2401 10.9759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8460 14.5624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6827 10.1218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0606 12.6111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6662 14.0888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9060 9.8514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7314 7.8573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9206 7.0156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2721 9.5791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3736 7.1675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1807 10.0045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0004 9.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9116 8.4312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0062 8.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1866 8.5845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2811 8.1637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5535 10.9877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3617 10.1288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5190 8.1380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8903 8.4242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8086 9.4242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6322 9.9922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5378 9.5606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6166 8.5651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7929 7.9973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8714 7.0018 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 18 22 1 0 0 0 0 20 23 1 0 0 0 0 28 34 1 0 0 0 33 27 1 0 0 0 27 29 1 0 0 0 29 30 1 0 0 0 30 31 1 0 0 0 31 32 1 0 0 0 32 33 1 0 0 0 33 34 1 1 0 0 30 24 1 6 0 0 31 25 1 1 0 0 32 26 1 6 0 0 43 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 0 0 0 42 43 1 0 0 0 43 44 1 6 0 0 39 24 1 1 0 0 40 35 1 6 0 0 41 36 1 6 0 0 42 37 1 1 0 0 29 19 1 1 0 0 M END > LMPK12112593 > Kaempferol 7,4'-dimethyl ether 3-neohesperidoside > > C29H34O15 > 622.19 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > JIKPQXBHZBMAEG-BVCXJCEXSA-N > InChI=1S/C29H34O15/c1-11-19(32)22(35)24(37)28(40-11)44-27-23(36)20(33)17(10-30)42-29(27)43-26-21(34)18-15(31)8-14(39-3)9-16(18)41-25(26)12-4-6-13(38-2)7-5-12/h4-9,11,17,19-20,22-24,27-33,35-37H,10H2,1-3H3/t11-,17+,19-,20+,22+,23-,24+,27+,28-,29-/m0/s1 > C1C=C(OC)C=CC=1C1=C(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)[C@@H](O)[C@H](O)[C@@H](CO)O2)C(=O)C2C(O)=CC(OC)=CC=2O1 > - > - > - > - > - > - > 178336229 > - > - > - > - > - > 33090 > - $$$$