LMPK12112114 LIPID_MAPS_STRUCTURE_DATABASE 54 59 0 0 0 0 0 0 0 0999 V2000 8.2444 13.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2444 12.6829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0907 12.1943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9369 12.6829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9369 13.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0907 14.1486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7831 12.1943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6294 12.6829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6294 13.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7831 14.1486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7831 11.4324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4754 14.1485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3378 13.6504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2003 14.1485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2003 15.1443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3378 15.6422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4754 15.1443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3986 14.1485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2290 12.0913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0907 11.2176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1645 15.7010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3378 16.6377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7769 10.8046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4227 8.7965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5103 8.1030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0799 10.7622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9539 8.3945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0398 11.1132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8206 10.4580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6418 9.4516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6856 9.1050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9047 9.7603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9484 9.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5064 7.0730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1380 5.0674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2207 4.3876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8091 7.0496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6664 4.6899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7715 7.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5477 6.7331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3618 5.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4031 5.3882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 6.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6682 5.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2288 12.2360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1945 11.6942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7047 9.7249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0169 9.5469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7579 10.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4837 11.2513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4688 10.9785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7237 9.9938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9979 9.2782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2529 8.2935 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 21 15 1 0 0 0 0 16 22 1 0 0 0 0 27 33 1 0 0 0 32 26 1 0 0 0 26 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 0 0 0 32 33 1 1 0 0 29 23 1 6 0 0 30 24 1 1 0 0 31 25 1 6 0 0 38 44 1 0 0 0 43 37 1 0 0 0 37 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 27 1 1 0 0 40 34 1 6 0 0 41 35 1 1 0 0 42 36 1 6 0 0 28 19 1 1 0 0 53 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 6 0 0 49 23 1 1 0 0 50 45 1 6 0 0 51 46 1 6 0 0 52 47 1 1 0 0 M END > LMPK12112114 > Quercetin 3-(2G-rhamnosylgentiobioside) > 3,5,7,3',4'-Pentahydroxyflavone 3-[2G-rhamnosyl-glucosyl-(1->6)-glucoside] > C33H40O21 > 772.21 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > NRTALHZHXXNSOY-WHBTYZLHSA-N > InChI=1S/C33H40O21/c1-9-19(39)23(43)27(47)32(49-9)54-30-25(45)21(41)17(8-48-31-26(46)24(44)20(40)16(7-34)51-31)52-33(30)53-29-22(42)18-14(38)5-11(35)6-15(18)50-28(29)10-2-3-12(36)13(37)4-10/h2-6,9,16-17,19-21,23-27,30-41,43-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21+,23+,24-,25-,26+,27+,30+,31+,32-,33-/m0/s1 > C1(O)=CC2OC(C3C=C(O)C(O)=CC=3)=C(O[C@H]3[C@H](O[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)[C@@H](O)[C@H](O)[C@@H](CO[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 178336165 > - > - > - > - > - > 33090; 66647 > - $$$$