LMPK12112427 LIPID_MAPS_STRUCTURE_DATABASE 54 59 0 0 0 999 V2000 10.4011 11.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4011 10.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2681 9.8165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1350 10.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1350 11.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2681 11.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0018 9.8165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8687 10.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8687 11.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0018 11.8184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0018 9.0359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7354 11.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6188 11.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5023 11.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5023 12.8386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6188 13.3486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7354 12.8386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5346 11.8183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7109 9.7847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2681 8.8156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4902 13.4090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6188 14.3685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3857 11.3084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2586 10.9533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0727 10.1072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2445 8.1177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6136 8.3852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7412 6.4648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5248 9.3845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3443 9.9584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2532 9.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3388 8.5385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5191 7.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6049 6.9697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8826 4.6570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8872 4.4967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7555 6.1420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1752 7.2086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7460 6.3835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3166 5.4796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3164 5.4006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7507 6.2233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1800 7.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6141 7.9498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7093 9.9337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7139 9.7735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5822 11.4187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0019 12.4854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5727 11.6602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1433 10.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1431 10.6774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5774 11.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0067 12.4039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4408 13.2265 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 14 23 1 0 0 0 0 28 34 1 0 0 0 33 27 1 0 0 0 27 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 0 0 0 33 34 1 1 0 0 30 24 1 6 0 0 31 25 1 1 0 0 32 26 1 6 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 6 0 0 39 28 1 1 0 0 40 35 1 6 0 0 41 36 1 6 0 0 42 37 1 1 0 0 29 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 50 45 1 6 0 0 51 46 1 6 0 0 52 47 1 1 0 0 49 18 1 1 0 0 M END > LMPK12112427 > Myricetin 3-rutinoside-7-rhamnoside > > C33H40O21 > 772.21 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > PUGCFQSSZSFPTE-PXZNGTTPSA-N > InChI=1S/C33H40O21/c1-8-18(37)23(42)26(45)31(49-8)48-7-16-21(40)25(44)28(47)33(53-16)54-30-22(41)17-12(34)5-11(51-32-27(46)24(43)19(38)9(2)50-32)6-15(17)52-29(30)10-3-13(35)20(39)14(36)4-10/h3-6,8-9,16,18-19,21,23-28,31-40,42-47H,7H2,1-2H3/t8-,9-,16+,18-,19-,21+,23+,24+,25-,26+,27+,28+,31+,32-,33-/m0/s1 > C1(O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)=CC2OC(C3C=C(O)C(O)=C(O)C=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](C)O4)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 102180243 > - > - > - > - > - > 33090 > - $$$$