LMPK12113142 LIPID_MAPS_STRUCTURE_DATABASE 47 51 0 0 0 0 0 0 0 0999 V2000 12.0975 16.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0975 15.7866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9795 15.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8614 15.7866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8614 16.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9795 17.3143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2153 15.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3334 15.7866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4514 15.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4514 14.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3334 13.7496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2153 14.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5693 15.7866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6873 15.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6873 14.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5693 13.7496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3334 12.8629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8053 15.7866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0432 13.7809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6031 17.2332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5693 12.8860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5693 16.5939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0166 15.3311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9196 12.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6543 12.8662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9209 11.1127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8021 10.6053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8034 9.5881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9220 9.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9233 8.0592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8059 7.5510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6874 8.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6861 9.0798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8071 6.5339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2103 7.3446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2114 6.4481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7568 12.7753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7426 10.7882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0175 9.8113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1721 12.2965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4748 9.8385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0375 12.7896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8942 12.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8858 11.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0233 10.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1666 11.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3040 10.8168 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 13 22 1 0 0 0 0 18 23 1 0 0 0 0 24 25 2 0 0 0 0 24 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 32 1 0 0 0 0 32 33 2 0 0 0 0 33 28 1 0 0 0 0 31 34 1 0 0 0 0 30 35 1 0 0 0 0 35 36 1 0 0 0 0 41 47 1 0 0 0 46 40 1 0 0 0 40 42 1 0 0 0 42 43 1 0 0 0 43 44 1 0 0 0 44 45 1 0 0 0 45 46 1 0 0 0 46 47 1 1 0 0 42 19 1 1 0 0 43 37 1 6 0 0 44 38 1 1 0 0 45 39 1 6 0 0 37 24 1 0 0 0 0 M END > LMPK12113142 > Herbacetin 7-methyl ether 3-(2''-(E)-feruloylglucoside) > 5,8-Dihydroxy-3- [ [ 2-O- [ (2E) -3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-2-(4-hydroxyphenyl)-7-methoxy-4H-1-benzopyran-4-one > C32H30O15 > 654.16 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > 7-O-methylherbacetin 3-O-[2-O-E-feruloyl-beta-D-glucoside] > ZRJRMZVLTQXGBI-VDNSIIFUSA-N > InChI=1S/C32H30O15/c1-42-19-11-14(3-9-17(19)35)4-10-22(37)45-31-27(41)24(38)21(13-33)44-32(31)47-30-26(40)23-18(36)12-20(43-2)25(39)29(23)46-28(30)15-5-7-16(34)8-6-15/h3-12,21,24,27,31-36,38-39,41H,13H2,1-2H3/b10-4+/t21-,24-,27+,31-,32+/m1/s1 > C1C=C(O)C=CC=1C1=C(O[C@H]2[C@H](OC(/C=C/C3C=CC(O)=C(OC)C=3)=O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C(=O)C2C(O)=CC(OC)=C(O)C=2O1 > - > - > - > - > - > - > 101701428 > - > - > - > - > - > 33090; 35930 > - $$$$