LMPK12110540 LIPID_MAPS_STRUCTURE_DATABASE 43 47 0 0 0 0 0 0 0 0999 V2000 8.0029 -6.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0029 -7.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8862 -8.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7694 -7.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7694 -6.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8862 -6.4406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6530 -8.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5362 -7.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5362 -6.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6530 -6.4406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6530 -9.2757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 -6.4407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8862 -9.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5175 -6.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4481 -6.9452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3789 -6.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3789 -5.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4481 -4.7957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5175 -5.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0956 -4.7710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3091 -6.9451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9337 -9.9464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2497 -10.9187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5707 -9.9466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2495 -8.0020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8296 -8.6310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0943 -8.4882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0943 -9.4603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2495 -9.9466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4102 -9.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4102 -8.4883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5707 -8.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9860 -7.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9721 -9.8737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2839 -10.8298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4566 -8.3976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7742 -10.8031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3034 -7.9151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1418 -8.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1336 -9.3819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2895 -9.8597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4511 -9.3677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6070 -9.8457 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 1 12 1 0 0 0 0 3 13 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 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 14 9 1 0 0 0 0 17 20 1 0 0 0 0 16 21 1 0 0 0 0 26 32 1 0 0 0 31 25 1 0 0 0 25 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 1 0 0 0 31 32 1 1 0 0 28 22 1 6 0 0 29 23 1 1 0 0 30 24 1 6 0 0 27 2 1 1 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 38 21 1 1 0 0 39 33 1 6 0 0 40 34 1 1 0 0 41 35 1 6 0 0 M END > LMPK12110540 > Isoorientin 3'-O-glucoside > 6-beta-D-Glucopyranosyl-3'-(beta-D-glucopyranosyloxy)-4',5,7-trihydroxyflavone > C27H30O16 > 610.15 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > RKWLAYUASOOQTJ-KETMJRJWSA-N > InChI=1S/C27H30O16/c28-6-15-19(33)22(36)24(38)26(41-15)18-11(32)5-14-17(21(18)35)10(31)4-12(40-14)8-1-2-9(30)13(3-8)42-27-25(39)23(37)20(34)16(7-29)43-27/h1-5,15-16,19-20,22-30,32-39H,6-7H2/t15-,16-,19-,20-,22+,23+,24-,25-,26+,27-/m1/s1 > C1(O)=CC2OC(C3C=CC(O)=C(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)C=3)=CC(=O)C=2C(O)=C1[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1 > - > - > - > - > - > - > 102148585 > - > - > - > - > - > 33090; 38852 > - $$$$