LMPK12111694 LIPID_MAPS_STRUCTURE_DATABASE 58 63 0 0 0 0 0 0 0 0999 V2000 7.3603 14.0359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3603 13.0301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2315 12.5272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1024 13.0301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1024 14.0359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2315 14.5387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9735 12.5272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8445 13.0301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8445 14.0359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9735 14.5387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9735 11.7430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9414 14.7324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8293 14.2199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7170 14.7324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7170 15.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8293 16.2700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9414 15.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2315 11.5219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6671 16.3061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5530 14.7465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8301 12.4611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5368 8.3639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5017 7.3589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4246 8.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2776 8.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1655 8.7755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2004 9.7748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0831 10.2444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9313 9.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8964 8.7153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0137 8.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7908 10.2365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.7782 8.2316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0611 11.2498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.9208 11.7716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6380 8.7535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5897 11.6255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7458 9.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1443 8.5817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1061 10.9367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6353 8.4763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9091 11.4925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7890 11.0746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8658 10.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0653 9.5503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1854 9.9681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3847 9.4173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0907 12.8670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9168 12.1876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2383 10.2707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6651 10.3252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6959 8.8585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5010 11.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2515 11.9085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1663 11.5668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3270 10.6084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5765 9.9877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7372 9.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 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 5 1 0 0 0 0 7 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 2 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 17 2 0 0 0 0 17 12 1 0 0 0 0 3 18 1 0 0 0 0 19 15 1 0 0 0 0 4 3 1 0 0 0 0 1 20 1 0 0 0 0 21 8 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 25 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 26 1 0 0 0 0 29 32 1 0 0 0 0 28 34 1 0 0 0 0 30 33 1 0 0 0 0 34 35 1 0 0 0 0 33 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 21 1 1 0 0 43 37 1 6 0 0 44 38 1 1 0 0 45 39 1 1 0 0 52 58 1 0 0 0 57 51 1 0 0 0 51 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 0 0 0 56 57 1 0 0 0 57 58 1 1 0 0 53 37 1 1 0 0 54 48 1 6 0 0 55 49 1 1 0 0 56 50 1 6 0 0 52 22 1 0 0 0 0 M END > LMPK12111694 > Kaempferol 3-(6''-sinapylglucosyl)-(1->2)-galactoside > 3,5,7,4'-Tetrahydroxyflavone 3-(6"-sinapylglucosyl-(1->2)-galactoside > C38H40O20 > 816.21 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > GCZWMUSXVIZQRI-HHEZHDPJSA-N > InChI=1S/C38H40O20/c1-51-21-9-15(10-22(52-2)27(21)44)3-8-25(43)53-14-24-29(46)31(48)33(50)37(56-24)58-36-32(49)28(45)23(13-39)55-38(36)57-35-30(47)26-19(42)11-18(41)12-20(26)54-34(35)16-4-6-17(40)7-5-16/h3-12,23-24,28-29,31-33,36-42,44-46,48-50H,13-14H2,1-2H3/b8-3+/t23-,24-,28+,29-,31+,32+,33-,36-,37+,38+/m1/s1 > C1(O)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(/C=C/C5C=C(OC)C(O)=C(OC)C=5)=O)O4)[C@@H](O)[C@@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 101165192 > - > - > - > - > - > 33090; 52862 > 7546562 $$$$