LMPK12110226 LIPID_MAPS_STRUCTURE_DATABASE 44 48 0 0 0 999 V2000 8.3402 12.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3402 13.5711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6356 12.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0800 9.2243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0800 8.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9381 7.7378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7963 8.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7963 9.2243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9381 9.7199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6546 7.7378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5127 8.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5127 9.2243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6546 9.7199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6546 6.9652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2220 9.7196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9381 6.7472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4660 9.7514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3704 9.2293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2749 9.7514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2749 10.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3704 11.3178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4660 10.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1784 11.3175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2215 10.6547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2216 12.6564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9523 13.6528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8216 11.1554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5065 13.6363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9535 10.6525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0869 11.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0884 12.1562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9536 12.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8202 12.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6856 12.6520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6793 9.3791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8033 10.0771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4729 12.0466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1166 11.9906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2852 11.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5142 10.3639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5743 10.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4092 11.6997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1803 12.3374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0151 13.3222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 4 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 8 1 0 0 0 0 10 14 2 0 0 0 0 4 15 1 0 0 0 0 6 16 1 0 0 0 0 17 18 2 0 0 0 0 18 19 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 17 1 0 0 0 0 17 12 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 29 9 1 1 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 37 1 1 0 0 0 0 M END > LMPK12110226 > Vitexin 2''-O-rhamnoside-4'''-acetate > > C29H32O15 > 620.17 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > Swertisin 6'''-O-feruloyl 2''-O-glucoside > RJQUXMJLUPJNPG-XRPNDKIMSA-N > InChI=1S/C29H32O15/c1-10-25(41-11(2)31)23(38)24(39)29(40-10)44-28-22(37)21(36)18(9-30)43-27(28)20-15(34)7-14(33)19-16(35)8-17(42-26(19)20)12-3-5-13(32)6-4-12/h3-8,10,18,21-25,27-30,32-34,36-39H,9H2,1-2H3/t10-,18+,21+,22-,23-,24+,25-,27-,28+,29-/m0/s1 > C(O[C@H]1[C@H](C)O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2C2=C(O)C=C(O)C3C(=O)C=C(C4C=CC(O)=CC=4)OC=32)[C@H](O)[C@@H]1O)(C)=O > - > - > - > - > - > - > 21721998 > - > - > - > - > - > 33090 > - $$$$