LMPK12110821 LIPID_MAPS_STRUCTURE_DATABASE 45 49 0 0 0 0 0 0 0 0999 V2000 16.4941 10.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4941 9.2503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3956 8.7298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2971 9.2503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2971 10.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3956 10.8116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5927 8.7298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6912 9.2503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7898 8.7298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7898 7.6890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6912 7.1685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5927 7.6890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8884 9.2503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9870 8.7298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9870 7.6890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8884 7.1685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6912 6.2623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0855 9.2503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8884 6.3031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1872 10.7978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.0219 8.8317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0727 10.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2865 7.4685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3252 7.2970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2005 8.9074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5731 9.9733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0834 10.4317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1402 9.1658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7242 8.2737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7410 8.1891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1788 8.9942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5948 9.8862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0325 10.6915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8127 5.9996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8719 4.0685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2605 6.0307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1499 6.4959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8473 5.8287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4103 4.9357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4313 5.0608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6568 4.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9932 3.3792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3842 11.1234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4355 10.8637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6336 12.0748 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 16 19 1 0 0 0 0 5 20 1 0 0 0 0 4 21 1 0 0 0 0 20 22 1 0 0 0 0 27 33 1 0 0 0 32 26 1 0 0 0 26 28 1 0 0 0 28 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 1 0 0 29 23 1 6 0 0 30 24 1 1 0 0 31 25 1 6 0 0 40 36 1 0 0 0 40 39 1 0 0 0 36 37 1 0 0 0 39 38 1 0 0 0 37 38 1 0 0 0 37 23 1 1 0 0 38 34 1 6 0 0 39 35 1 6 0 0 39 41 1 0 0 0 41 42 1 0 0 0 27 43 1 0 0 0 43 44 2 0 0 0 43 45 1 0 0 0 28 18 1 1 0 0 M END > LMPK12110821 > Diosmetin 7-Apiosyl-(1->2)-(6''-acetylglucoside) > 7-[(6-O-Acetyl-2-O-D-apio-beta-D-furanosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one > C29H32O16 > 636.17 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > 5,7,3?-trihydroxy-4?-methoxyflavone 7-Apiosyl-(1->2)-(6''-acetylglucoside) > FGALOZIRMNCSRZ-MIKDDSNXSA-N > InChI=1S/C29H32O16/c1-12(31)40-9-21-23(35)24(36)25(45-28-26(37)29(38,10-30)11-41-28)27(44-21)42-14-6-16(33)22-17(34)8-19(43-20(22)7-14)13-3-4-18(39-2)15(32)5-13/h3-8,21,23-28,30,32-33,35-38H,9-11H2,1-2H3/t21-,23-,24+,25-,26+,27-,28+,29-/m1/s1 > C1C=C(OC)C(O)=CC=1C1=CC(=O)C2C(O)=CC(O[C@H]3[C@H](O[C@H]4[C@H](O)[C@](CO)(O)CO4)[C@@H](O)[C@H](O)[C@@H](COC(C)=O)O3)=CC=2O1 > - > - > - > - > - > - > 10627850 > - > - > - > - > - > 33090; 290984 > 10479333 $$$$