LMPK12112212 LIPID_MAPS_STRUCTURE_DATABASE 42 46 0 0 0 999 V2000 7.5238 11.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5238 10.7801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4129 10.2669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3018 10.7801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3018 11.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4129 12.3201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1909 10.2669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0800 10.7801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0800 11.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1909 12.3201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1909 9.4664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9687 12.3199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8749 11.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7810 12.3199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7810 13.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8749 13.8892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9687 13.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4129 9.2406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7943 13.8679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 12.3201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0610 10.2140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8749 14.9353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7498 10.6937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7498 9.6716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6346 9.1607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6346 8.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3625 7.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0904 8.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0904 9.1607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3625 9.5809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8174 9.5805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8174 7.9006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3625 7.0606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8269 9.1776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8239 7.1721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0942 6.1765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2255 8.6723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0932 9.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9591 8.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9577 7.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0955 7.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2296 7.6791 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 3 18 1 0 0 0 0 19 15 1 0 0 0 0 20 1 1 0 0 0 0 21 8 1 0 0 0 0 16 22 1 0 0 0 0 23 24 2 0 0 0 0 24 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 37 42 1 0 0 0 42 41 1 0 0 0 41 40 1 0 0 0 40 39 1 0 0 0 39 38 1 0 0 0 38 37 1 0 0 0 39 34 1 6 0 0 40 35 1 1 0 0 41 36 1 1 0 0 38 21 1 1 0 0 24 34 1 0 0 0 M END > LMPK12112212 > Quercetin 3-(2''-galloyl-alpha-L-arabinopyranoside) > > C27H22O15 > 586.10 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > XLHGECRFSYAHQI-LEYCRWIUSA-N > InChI=1S/C27H22O15/c28-11-6-14(31)19-18(7-11)40-23(9-1-2-12(29)13(30)3-9)24(22(19)37)42-27-25(21(36)17(34)8-39-27)41-26(38)10-4-15(32)20(35)16(33)5-10/h1-7,17,21,25,27-36H,8H2/t17-,21-,25+,27-/m0/s1 > C1(O)=CC2OC(C3C=C(O)C(O)=CC=3)=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3OC(C3C=C(O)C(O)=C(O)C=3)=O)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 9985767 > - > - > - > - > - > 33090 > - $$$$