LMPK12112462 LIPID_MAPS_STRUCTURE_DATABASE 45 49 0 0 0 999 V2000 16.2348 12.0655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3557 12.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3557 13.5883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2348 14.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1139 13.5883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1139 12.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4765 12.0655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5975 12.5731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7183 12.0655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7183 11.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5975 10.5428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4765 11.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8392 12.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9600 12.0655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9600 11.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8392 10.5428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5975 9.6729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0810 12.5731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3557 10.5428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8392 9.6926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9930 14.0958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2348 15.1110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9482 12.0916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4111 6.8177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9107 5.9523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3973 6.8177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8905 5.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8766 5.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3691 6.8189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3540 6.8189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8465 5.9398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3540 5.0606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3691 5.0606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8326 5.9398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2315 9.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5650 7.8713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0246 6.6004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7512 8.9179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5234 9.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4612 9.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6271 8.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8569 7.5848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9191 7.9337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1488 7.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1842 7.5619 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 12 19 1 0 0 0 0 16 20 1 0 0 0 0 5 21 1 0 0 0 0 4 22 1 0 0 0 0 6 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 33 28 1 0 0 0 0 31 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 19 1 1 0 0 40 35 1 6 0 0 41 36 1 1 0 0 42 37 1 6 0 0 44 45 1 0 0 0 45 24 1 0 0 0 0 M END > LMPK12112462 > Myricetin 3-(6''-p-coumaroylglucoside) > > C30H26O15 > 626.13 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > YXYCRKXYUVVKEF-OKHFLWQVSA-N > InChI=1S/C30H26O15/c31-14-4-1-12(2-5-14)3-6-21(36)42-11-20-24(38)26(40)27(41)30(44-20)45-29-25(39)22-16(33)9-15(32)10-19(22)43-28(29)13-7-17(34)23(37)18(35)8-13/h1-10,20,24,26-27,30-35,37-38,40-41H,11H2/b6-3+/t20-,24-,26+,27-,30+/m1/s1 > C1C(O)=C(O)C(O)=CC=1C1=C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(/C=C/C3C=CC(O)=CC=3)=O)O2)C(=O)C2C(O)=CC(O)=CC=2O1 > - > - > - > - > - > - > 163106805 > - > - > - > - > - > 33090 > - $$$$