LMPK12112112 LIPID_MAPS_STRUCTURE_DATABASE 55 60 0 0 0 999 V2000 7.5826 15.4922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5826 14.5103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 14.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2834 14.5103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2834 15.4922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 15.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1339 14.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9844 14.5103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9844 15.4922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1339 15.9833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1339 13.2537 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8342 15.9830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7010 15.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5676 15.9830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5676 16.9837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7010 17.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8342 16.9837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7325 15.9830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5867 13.9158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 13.0378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5367 17.5431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7010 18.4848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1992 12.5814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8515 10.6101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9741 9.9294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5516 12.5398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4463 10.2155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4939 12.8843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2604 12.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0849 11.2532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1462 10.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3797 11.5562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4409 11.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9703 8.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6087 6.9494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7265 6.2821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3225 8.8953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2008 6.5789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2672 9.2332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0292 8.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8467 7.5979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9056 7.2644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1437 7.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2025 7.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9395 13.5698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6659 12.5566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6492 10.5597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0554 11.0739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8485 9.2276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0610 12.0771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9311 12.5713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7958 12.0623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7874 11.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9173 10.5698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9089 9.5713 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 49 55 1 0 0 0 54 48 1 0 0 0 48 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 0 0 0 54 55 1 1 0 0 50 23 1 1 0 0 51 45 1 6 0 0 52 46 1 1 0 0 53 47 1 6 0 0 M END > LMPK12112112 > Quercetin 3-(2G-glucosylgentiobioside) > > C33H40O22 > 788.20 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > QSUCYXFFQLQGKE-JGPRCQAHSA-N > InChI=1S/C33H40O22/c34-6-15-19(40)23(44)26(47)31(51-15)49-8-17-21(42)25(46)30(55-32-27(48)24(45)20(41)16(7-35)52-32)33(53-17)54-29-22(43)18-13(39)4-10(36)5-14(18)50-28(29)9-1-2-11(37)12(38)3-9/h1-5,15-17,19-21,23-27,30-42,44-48H,6-8H2/t15-,16-,17-,19-,20-,21-,23+,24+,25+,26-,27-,30-,31-,32+,33+/m1/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](CO)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 > - > - > - > - > - > - > 44259161 > - > - > - > - > - > 33090 > - $$$$