LMPK12112569 LIPID_MAPS_STRUCTURE_DATABASE 53 58 0 0 0 999 V2000 7.6280 12.3253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6280 11.2999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5162 10.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4044 11.2999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4044 12.3253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5162 12.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2926 10.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1807 11.2999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1807 12.3253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2926 12.8382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2926 9.8710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0673 12.8810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9725 12.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8776 12.8810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8776 13.9262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9725 14.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0673 13.9262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5162 9.8967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8467 14.4856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0576 10.6961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0971 7.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5842 6.1196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.0148 7.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5013 6.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4046 6.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9200 5.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9506 5.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4659 6.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9506 7.0581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9200 7.0581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3274 6.1656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 12.8034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0606 12.3766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5231 9.3164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0049 7.3829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0753 6.8684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8819 9.5057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5783 7.2866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8507 9.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5582 9.0592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2972 8.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3324 7.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6249 8.5408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6601 8.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6207 8.9230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8775 8.2538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6207 7.5847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5717 7.8937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2898 7.4448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3388 7.7538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3388 8.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2898 9.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5989 10.0139 0.0000 O 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 20 8 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 25 1 0 0 0 0 28 31 1 0 0 0 0 1 32 1 0 0 0 0 32 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 40 34 1 6 0 0 41 35 1 1 0 0 42 36 1 6 0 0 46 45 1 6 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 46 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 46 1 0 0 0 0 52 53 1 6 0 0 0 51 34 1 1 0 0 0 48 21 1 0 0 0 0 39 20 1 1 0 0 M END > LMPK12112569 > Rhamnocitrin 3-(5'''-p-coumarylapiosyl)-(1->2)-glucoside > > C36H36O17 > 740.20 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > UWRVNAYXPMAZQA-DYYPYGAYSA-N > InChI=1S/C36H36O17/c1-47-21-12-22(40)26-23(13-21)50-30(18-5-9-20(39)10-6-18)31(28(26)43)52-34-32(29(44)27(42)24(14-37)51-34)53-35-33(45)36(46,16-49-35)15-48-25(41)11-4-17-2-7-19(38)8-3-17/h2-13,24,27,29,32-35,37-40,42,44-46H,14-16H2,1H3/b11-4+/t24-,27-,29+,32-,33+,34+,35+,36-/m1/s1 > C1(OC)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](O[C@H]4[C@H](O)[C@](CO4)(COC(/C=C/C4C=CC(O)=CC=4)=O)O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 10439990 > - > - > - > - > - > 33090 > - $$$$