LMPK12112418 LIPID_MAPS_STRUCTURE_DATABASE 45 49 0 0 0 999 V2000 7.6518 10.4940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6518 9.5273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4890 9.0439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3261 9.5273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3261 10.4940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4890 10.9772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1633 9.0439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0004 9.5273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0004 10.4940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1633 10.9772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1633 8.2903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8372 10.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6904 10.4845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5436 10.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5436 11.9623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6904 12.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8372 11.9623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9758 8.6992 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3966 12.4548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4890 8.0777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7325 10.7927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4961 5.4282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4149 4.5001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6904 13.4399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6481 6.0632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7240 6.9311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0103 7.4308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2207 7.0626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1448 6.1947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8585 5.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3553 5.8266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5071 7.5622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0863 8.2987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3966 10.4846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7835 7.8407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9439 5.8452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2985 4.7135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2320 7.1330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0569 7.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9609 7.2747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0398 6.2744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2173 5.7086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3133 6.1379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4908 5.5720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5528 5.9186 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 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 18 8 1 0 0 0 0 15 19 1 0 0 0 0 3 20 1 0 0 0 0 1 21 1 0 0 0 0 22 23 2 0 0 0 0 16 24 1 0 0 0 0 22 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 29 31 1 0 0 0 0 28 32 1 0 0 0 0 27 33 1 0 0 0 0 14 34 1 0 0 0 0 43 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 0 0 0 43 44 1 1 0 0 39 18 1 1 0 0 40 35 1 6 0 0 41 36 1 1 0 0 42 37 1 1 0 0 44 45 1 0 0 0 45 22 1 0 0 0 0 M END > LMPK12112418 > Myricetin 3-(6''-galloylgalactoside) > > C28H24O17 > 632.10 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > FOMYLMGOSTVYEE-LEENXRGASA-N > InChI=1S/C28H24O17/c29-10-5-11(30)18-16(6-10)43-25(8-1-12(31)19(35)13(32)2-8)26(22(18)38)45-28-24(40)23(39)21(37)17(44-28)7-42-27(41)9-3-14(33)20(36)15(34)4-9/h1-6,17,21,23-24,28-37,39-40H,7H2/t17-,21+,23+,24-,28+/m1/s1 > C1(O)=CC2OC(C3C=C(O)C(O)=C(O)C=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@@H](O)[C@@H](COC(C4C=C(O)C(O)=C(O)C=4)=O)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 5319985 > - > - > - > - > - > 33090 > - $$$$