LMPK12111811 LIPID_MAPS_STRUCTURE_DATABASE 54 59 0 0 0 999 V2000 10.0974 11.9840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0974 10.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0023 10.4168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9070 10.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9070 11.9840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0023 12.5063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8116 10.4168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7164 10.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7164 11.9840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8116 12.5063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8116 9.6025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8555 12.7075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7775 12.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6998 12.7075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6998 13.7722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7775 14.3044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8555 13.7722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0023 9.3726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6865 14.3418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2588 12.7219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7399 10.3482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2027 9.7136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2010 10.7056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9773 9.3411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7816 9.7467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5377 9.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5377 8.2401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4683 7.7028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3986 8.2401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3986 9.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4683 9.8517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3280 7.7033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.3280 9.8511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4661 9.3352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4518 7.3336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7141 6.3495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8625 8.8530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1601 6.3770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7342 9.3497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5972 8.8432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5887 7.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7199 7.3480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8569 7.8545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9880 7.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0702 10.7294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2501 9.8964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6238 11.0554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5328 12.8852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3514 12.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2571 11.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3442 10.8926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5312 11.4722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6255 12.4683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8124 13.0479 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 23 22 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 30 33 1 0 0 0 0 38 44 1 0 0 0 43 37 1 0 0 0 37 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 1 0 0 39 21 1 1 0 0 40 34 1 6 0 0 41 35 1 1 0 0 42 36 1 6 0 0 34 22 1 0 0 0 0 53 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 0 0 0 53 54 1 6 0 0 49 20 1 1 0 0 50 45 1 6 0 0 51 46 1 6 0 0 52 47 1 1 0 0 M END > LMPK12111811 > Kaempferol 3-(2''-caffeylglucoside)-7-rhamnoside > > C36H36O18 > 756.19 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > ZFDYOOWTGQKEHM-BPKPFBPYSA-N > InChI=1S/C36H36O18/c1-14-26(43)29(46)31(48)35(49-14)50-18-11-21(41)25-22(12-18)51-32(16-4-6-17(38)7-5-16)33(28(25)45)54-36-34(30(47)27(44)23(13-37)52-36)53-24(42)9-3-15-2-8-19(39)20(40)10-15/h2-12,14,23,26-27,29-31,34-41,43-44,46-48H,13H2,1H3/b9-3+/t14-,23+,26-,27+,29+,30-,31+,34+,35-,36-/m0/s1 > C1(O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](OC(/C=C/C4C=C(O)C(O)=CC=4)=O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 178336120 > - > - > - > - > - > 33090 > - $$$$