LMPK12112221 LIPID_MAPS_STRUCTURE_DATABASE 46 50 0 0 0 0 0 0 0 0999 V2000 7.5530 10.4440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5530 9.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3961 8.9835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2393 9.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2393 10.4440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3961 10.9310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0824 8.9835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9257 9.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9257 10.4440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0824 10.9310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0824 8.2245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9874 11.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8467 10.6221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7061 11.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7061 12.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8467 12.6067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9874 12.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3961 8.0103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6260 12.6416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7714 11.1318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8796 8.9196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8467 13.5987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2929 7.4862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7580 5.5454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8136 5.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6380 7.6954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6141 7.9511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3207 7.2345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0513 6.2619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0792 6.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3726 6.7269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4004 6.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7994 3.0288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0487 2.0347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3178 3.0533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0700 5.0541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5601 4.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9410 4.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9339 3.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0557 3.0410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1904 3.5505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1975 4.5568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3319 5.0663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6156 4.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8441 4.1211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4426 5.7571 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 16 22 1 0 0 0 0 31 26 1 0 0 0 26 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 6 0 0 27 21 1 1 0 0 28 23 1 6 0 0 29 24 1 6 0 0 30 25 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 25 1 1 0 0 39 33 1 6 0 0 40 34 1 1 0 0 41 35 1 6 0 0 37 44 1 0 0 0 44 45 2 0 0 0 44 46 1 0 0 0 M END > LMPK12112221 > Quercetin 3-(6'''-acetylglucosyl)(1->4)-rhamnoside > 3,5,7,3',4'-Pentahydroxyflavone 3-(6"'-acetylglucosyl)(1->4)-rhamnoside > C29H32O17 > 652.16 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > AATRYBSLZLJIJX-MNMPECKNSA-N > InChI=1S/C29H32O17/c1-9-25(45-29-23(39)21(37)19(35)17(44-29)8-41-10(2)30)22(38)24(40)28(42-9)46-27-20(36)18-15(34)6-12(31)7-16(18)43-26(27)11-3-4-13(32)14(33)5-11/h3-7,9,17,19,21-25,28-29,31-35,37-40H,8H2,1-2H3/t9-,17+,19+,21-,22-,23+,24+,25-,28-,29-/m0/s1 > C1(O)=CC2OC(C3C=C(O)C(O)=CC=3)=C(O[C@H]3[C@H](O)[C@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(C)=O)O4)[C@H](C)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 9809745 > - > - > - > - > - > 33090; 74647 > - $$$$