LMPK12111696 LIPID_MAPS_STRUCTURE_DATABASE 53 58 0 0 0 999 V2000 7.5638 12.1982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5638 11.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3951 10.7585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2263 11.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2263 12.1982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3951 12.6782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0577 10.7585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8890 11.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8890 12.1982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0577 12.6782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0577 10.0098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7202 12.6781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5673 12.1889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4146 12.6781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4146 13.6564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5673 14.1456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7202 13.6564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3951 9.7987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0329 10.6262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 12.6781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2617 14.1454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1582 9.2779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1107 8.7281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0625 9.2778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0147 8.7281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1582 9.7908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.0147 7.7868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8297 7.3162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6448 7.7868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6448 8.7281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8297 9.1987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4599 7.3164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7849 11.6262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5185 10.6252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5159 8.6282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9186 9.1240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9664 7.0493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9170 10.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7837 10.6277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6519 10.1247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6507 9.1264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7840 8.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7828 7.6275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7779 5.0568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9577 4.2238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3315 5.3828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2404 7.2126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0590 6.6325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9647 5.6364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0519 5.2200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2389 5.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3332 6.7957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5201 7.3753 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 3 4 1 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 8 1 0 0 0 0 1 20 1 0 0 0 0 15 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 22 26 2 0 0 0 0 25 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 25 1 0 0 0 0 29 32 1 0 0 0 0 37 43 1 0 0 0 42 36 1 0 0 0 36 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 1 0 0 39 33 1 6 0 0 40 34 1 1 0 0 41 35 1 1 0 0 52 47 1 0 0 0 47 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 6 0 0 48 37 1 1 0 0 49 44 1 6 0 0 50 45 1 6 0 0 51 46 1 1 0 0 38 19 1 1 0 0 35 22 1 0 0 0 0 M END > LMPK12111696 > Kaempferol 3-(4''-(E)-p-coumarylrobinobioside) > > C36H36O17 > 740.20 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > ZTNSLUBWMOQPPH-RNCAIXGQSA-N > InChI=1S/C36H36O17/c1-15-26(42)28(44)30(46)35(49-15)48-14-23-33(52-24(41)11-4-16-2-7-18(37)8-3-16)29(45)31(47)36(51-23)53-34-27(43)25-21(40)12-20(39)13-22(25)50-32(34)17-5-9-19(38)10-6-17/h2-13,15,23,26,28-31,33,35-40,42,44-47H,14H2,1H3/b11-4+/t15-,23+,26-,28+,29+,30+,31+,33-,35+,36-/m0/s1 > C1(O)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@@H](OC(=O)/C=C/C4C=CC(O)=CC=4)[C@@H](CO[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 44258768 > - > - > - > - > - > 33090 > - $$$$