LMPK12111969 LIPID_MAPS_STRUCTURE_DATABASE 53 58 0 0 0 999 V2000 16.2820 15.7782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2820 14.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2120 14.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1421 14.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1421 15.7782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2120 16.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3519 14.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4220 14.7043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4919 14.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4919 13.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4220 12.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3519 13.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5619 14.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6318 14.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6318 13.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5619 12.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4220 11.6216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7018 14.7043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2340 12.5274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9240 16.2299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5619 11.6460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8964 11.4183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7219 9.4243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9109 8.5826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2626 11.1461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1712 11.5715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9909 10.9975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9021 9.9981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9967 9.5774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1770 10.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2715 9.7305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7373 12.6997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0038 11.6989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2756 12.6996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0036 14.7011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8732 14.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8732 13.2001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0036 12.6996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1397 13.1999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1397 14.2006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2756 14.7009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7819 12.0895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.3061 10.7920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9430 8.8283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4778 9.7850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6576 10.7721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6003 11.1076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3634 10.4563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1818 9.4745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2391 9.1389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4089 13.1984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5435 12.6973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4076 14.1984 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 30 25 1 0 0 0 25 26 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 1 6 0 0 27 22 1 6 0 0 28 23 1 6 0 0 29 24 1 1 0 0 40 35 1 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 37 38 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 41 1 6 0 0 37 32 1 6 0 0 38 33 1 6 0 0 39 34 1 1 0 0 50 45 1 0 0 0 45 46 1 0 0 0 46 47 1 0 0 0 47 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 46 22 1 1 0 0 47 42 1 6 0 0 48 43 1 1 0 0 49 44 1 6 0 0 26 19 1 1 0 0 34 51 1 0 0 0 51 52 2 0 0 0 51 53 1 0 0 0 36 18 1 1 0 0 M END > LMPK12111969 > 4''''-Acetylsagittatin A > > C34H40O19 > 752.22 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > Kaempferol 3-xylosyl(1->2)rhamnoside-7-(4''-acetylrhamnoside) > RPDNKMCDJHBQTM-NLOCSJTESA-N > InChI=1S/C34H40O19/c1-11-21(39)24(42)31(53-32-26(44)22(40)18(38)10-46-32)34(47-11)52-30-23(41)20-17(37)8-16(9-19(20)51-29(30)14-4-6-15(36)7-5-14)50-33-27(45)25(43)28(12(2)48-33)49-13(3)35/h4-9,11-12,18,21-22,24-28,31-34,36-40,42-45H,10H2,1-3H3/t11-,12-,18+,21-,22-,24+,25-,26+,27+,28-,31+,32-,33-,34-/m0/s1 > C1C=C(O)C=CC=1C1=C(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)CO3)[C@H](O)[C@@H](O)[C@H](C)O2)C(=O)C2C(O)=CC(O[C@H]3[C@H](O)[C@H](O)[C@@H](OC(C)=O)[C@H](C)O3)=CC=2O1 > - > - > - > - > - > - > 10652650 > - > - > - > - > - > 33090 > - $$$$