LMPK12112008 LIPID_MAPS_STRUCTURE_DATABASE 49 53 0 0 0 999 V2000 11.8116 8.7384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8116 7.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7395 7.1314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6671 7.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6671 8.7384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7395 9.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5948 7.1314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5226 7.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5226 8.7384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5948 9.2740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5948 6.2963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4500 9.2737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3957 8.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3411 9.2737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3411 10.3655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3957 10.9113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4500 10.3655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8842 9.2737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2731 7.1955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7395 6.0606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7395 10.3449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8119 10.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8119 11.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7395 12.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8846 12.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2863 10.9113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0938 10.4450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6956 7.2811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8755 6.4481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2492 7.6071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1582 9.4370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6173 9.0272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9768 8.8569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8825 7.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9696 7.4443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1566 8.0239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2509 9.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4378 9.5997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9993 6.1825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9850 4.1809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2473 3.1968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3957 5.7002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6933 3.2242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2674 6.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1304 5.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1219 4.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2531 4.1953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3901 4.7018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5212 4.2098 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 1 18 1 0 0 0 0 8 19 1 0 0 0 0 3 20 1 0 0 0 0 6 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 15 26 1 0 0 0 0 26 27 1 0 0 0 0 32 38 1 0 0 0 37 31 1 0 0 0 31 33 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 37 38 1 1 0 0 33 18 1 1 0 0 34 28 1 6 0 0 35 29 1 1 0 0 36 30 1 6 0 0 43 49 1 0 0 0 48 42 1 0 0 0 42 44 1 0 0 0 44 45 1 0 0 0 45 46 1 0 0 0 46 47 1 0 0 0 47 48 1 0 0 0 48 49 1 1 0 0 44 19 1 1 0 0 45 39 1 6 0 0 46 40 1 1 0 0 47 41 1 6 0 0 M END > LMPK12112008 > Anhydroicaritin 3,7-diglucoside > > C33H40O16 > 692.23 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > OKSDRSVOPASNHO-KSEOACTISA-N > InChI=1S/C33H40O16/c1-13(2)4-9-16-18(45-32-27(42)25(40)22(37)19(11-34)46-32)10-17(36)21-24(39)31(49-33-28(43)26(41)23(38)20(12-35)47-33)29(48-30(16)21)14-5-7-15(44-3)8-6-14/h4-8,10,19-20,22-23,25-28,32-38,40-43H,9,11-12H2,1-3H3/t19-,20-,22-,23-,25+,26+,27-,28-,32-,33+/m1/s1 > C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C(C/C=C(/C)\C)C2OC(C3C=CC(OC)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 102075698 > - > - > - > - > - > 33090 > - $$$$