LMPK12112096 LIPID_MAPS_STRUCTURE_DATABASE 44 48 0 0 0 0 0 0 0 0999 V2000 7.5694 12.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5747 11.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4522 10.5121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3242 11.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3191 12.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4415 12.5326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2016 10.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0739 11.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0686 12.0411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1912 12.5415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2057 9.7336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9406 12.5505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8349 12.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7238 12.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7186 13.5891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8240 14.0993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9353 13.5799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6922 12.5234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4573 9.5027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3137 13.9370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0602 10.0984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8189 15.1285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3009 11.6275 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2604 11.2819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9370 9.4159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3422 8.9958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8998 7.2483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9998 9.9325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6391 10.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6211 10.5199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9593 9.5869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3198 8.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6581 7.8918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8856 5.2590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1555 4.2764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4447 5.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1764 7.2606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6959 6.6346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0373 6.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0303 5.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1623 5.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3071 5.7745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3141 6.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4588 7.2726 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 3 19 1 0 0 0 0 20 15 1 0 0 0 0 21 8 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 21 1 1 0 0 M END > LMPK12112096 > Quercetin 3-gentiobioside > 3-[[6-O-(beta-D-Glucopyranosyl)-beta-D-glucopyranosyl]oxy]-3',4',5,7-tetrahydroxyflavone > C27H30O17 > 626.15 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > FDRQPMVGJOQVTL-DEFKTLOSSA-N > InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)40-7-15-18(34)21(37)23(39)27(43-15)44-25-19(35)16-12(32)4-9(29)5-13(16)41-24(25)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/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](CO[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)O3)C(=O)C=2C(O)=C1 > - > - > 136778 > - > - > - > 5320834 > - > - > - > - > - > 33090; 170926 > 13711452 $$$$