LMPK12110531 LIPID_MAPS_STRUCTURE_DATABASE 38 41 0 0 0 0 0 0 0 0999 V2000 8.8937 11.6711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2984 12.3723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9139 12.9954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2720 13.6154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1712 13.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8210 12.4571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2451 10.8266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2451 9.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1449 9.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0448 9.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0448 10.8266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1449 11.3462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9445 9.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8444 9.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8444 10.8266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9445 11.3462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9445 8.4582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3458 11.3459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8439 11.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7817 10.8144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7399 11.3445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7599 12.4391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8219 13.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8640 12.4741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6597 12.9586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1449 8.2296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8219 14.0429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3938 12.3829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3939 14.3954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1339 15.3970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0079 12.8863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6965 15.3805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1351 12.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2639 12.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2652 13.8925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1352 14.3931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0064 13.8901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8765 14.3909 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 1 0 0 0 0 3 5 1 0 0 0 0 5 6 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 11 2 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 10 13 1 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 11 1 0 0 0 0 13 17 2 0 0 0 0 7 18 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 19 1 0 0 0 0 19 15 1 0 0 0 0 22 25 1 0 0 0 0 9 26 1 0 0 0 0 23 27 1 0 0 0 0 32 38 1 0 0 0 37 31 1 0 0 0 31 33 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 37 38 1 1 0 0 34 28 1 6 0 0 35 29 1 1 0 0 36 30 1 6 0 0 33 12 1 1 0 0 2 28 1 0 0 0 0 M END > LMPK12110531 > Orientin 2''-O-(2'''-methylbutyrate) > 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-8-[2-O-(2-methylbutyryl)-beta-D-glucopyranosyl]-4H-1-benzopyran-4-one > C26H28O12 > 532.16 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > IXJHFORJGDOBHK-JXYLWMJSSA-N > InChI=1S/C26H28O12/c1-3-10(2)26(35)38-25-22(34)21(33)18(9-27)37-24(25)20-15(31)7-14(30)19-16(32)8-17(36-23(19)20)11-4-5-12(28)13(29)6-11/h4-8,10,18,21-22,24-25,27-31,33-34H,3,9H2,1-2H3/t10?,18-,21-,22+,24+,25-/m1/s1 > O=C(O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1C1=C(O)C=C(O)C2C(=O)C=C(C3C=C(O)C(O)=CC=3)OC=21)C(CC)C > - > - > - > - > - > - > 21578037 > - > - > - > - > - > 33090; 46346 > 15104499 $$$$