LMPK12110626 LIPID_MAPS_STRUCTURE_DATABASE 56 61 0 0 0 0 0 0 0 0999 V2000 8.9993 12.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2714 12.2198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8544 12.9478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3809 12.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6003 12.1201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0933 11.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0796 11.2663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5725 12.1202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0795 12.9741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0936 12.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5571 12.1201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3666 10.7692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2072 10.7693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5845 16.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5845 15.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4778 15.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3710 15.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3710 16.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4778 17.3608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2645 15.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1577 15.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1577 16.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2645 17.3608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2645 14.4936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6917 17.3606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4778 14.2669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1501 17.3936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0912 16.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0325 17.3936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0325 18.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0912 19.0242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1501 18.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7574 19.0491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9732 16.8506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5146 13.8153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8115 12.8321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1136 13.8151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8113 15.7816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 15.1456 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6656 15.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6656 14.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8113 13.8151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 14.3067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 15.2899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1136 15.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6009 20.8253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5612 20.9827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6732 19.3663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2959 18.3184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7794 17.8429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7351 19.1290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1569 20.0170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1396 20.0947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6953 19.2864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2736 18.3983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8296 17.5901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 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 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 8 11 1 0 0 0 0 7 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 14 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 18 1 0 0 0 0 20 24 2 0 0 0 0 14 25 1 0 0 0 0 16 26 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 31 1 0 0 0 0 31 32 2 0 0 0 0 32 27 1 0 0 0 0 27 22 1 0 0 0 0 30 33 1 0 0 0 0 29 34 1 0 0 0 0 39 45 1 0 0 0 44 38 1 0 0 0 38 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 0 0 0 44 45 1 1 0 0 41 35 1 6 0 0 42 36 1 1 0 0 43 37 1 6 0 0 40 15 1 1 0 0 50 56 1 0 0 0 55 49 1 0 0 0 49 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 1 0 0 51 33 1 1 0 0 52 46 1 6 0 0 53 47 1 1 0 0 54 48 1 6 0 0 35 1 1 0 0 0 0 M END > LMPK12110626 > Isoorientin 4'-O-glucoside 2''-O-(E)-ferulate > 5,7,3',4'-Tetrahydroxyflavone 6-C-(2"-O-(E)-ferulylglucoside)-4'-O-glucoside > C37H38O19 > 786.20 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > ANBZFYYSBLEBRA-PZTWNTRFSA-N > InChI=1S/C37H38O19/c1-51-22-8-14(2-5-16(22)40)3-7-26(44)56-36-33(49)30(46)24(12-38)53-35(36)28-19(43)11-23-27(31(28)47)18(42)10-21(52-23)15-4-6-20(17(41)9-15)54-37-34(50)32(48)29(45)25(13-39)55-37/h2-11,24-25,29-30,32-41,43,45-50H,12-13H2,1H3/b7-3+/t24-,25-,29-,30-,32+,33+,34-,35+,36-,37-/m1/s1 > C(O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1C1=C(O)C2C(=O)C=C(C3C=CC(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)=C(O)C=3)OC=2C=C1O)(/C=C/C1C=CC(O)=C(OC)C=1)=O > - > - > - > - > - > - > 178336029 > - > - > - > - > - > 33090; 38850 > - $$$$