LMPK12112242 LIPID_MAPS_STRUCTURE_DATABASE 52 57 0 0 0 999 V2000 16.4224 11.9976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4225 10.9785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3049 10.4689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1877 10.9784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1876 11.9977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3052 12.5072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5397 10.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6571 10.9783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7744 10.4687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7744 9.4496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6570 8.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5398 9.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8920 10.9782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0091 10.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0092 9.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8918 8.9399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6570 7.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9592 10.7991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4224 8.9399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8918 7.9207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9189 12.4199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9643 10.5300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1187 8.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1379 8.7783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0144 10.4116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4164 11.4704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9071 11.9508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9831 10.6513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5569 9.7541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5640 9.6756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0023 10.4923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4285 11.3895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8668 12.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7560 10.3315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7779 10.5187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9549 12.3223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5043 12.9479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9202 12.0429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3447 11.2332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3532 11.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9419 12.2302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5174 13.0398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 13.9416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7379 7.7864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5507 5.8082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7471 4.9854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1215 7.5347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0265 7.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8362 7.3751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7410 6.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8392 5.9723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0296 6.5478 0.0000 C 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 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 42 37 1 0 0 0 37 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 6 0 0 38 27 1 1 0 0 39 34 1 6 0 0 40 35 1 6 0 0 41 36 1 1 0 0 28 18 1 1 0 0 52 47 1 0 0 0 47 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 48 23 1 1 0 0 49 44 1 6 0 0 50 45 1 1 0 0 51 46 1 6 0 0 M END > LMPK12112242 > Quercetin 7-(2G-xylosylrutinoside) > > C32H38O20 > 742.20 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > DJKDEEYUURAWII-PYNGTBFNSA-N > InChI=1S/C32H38O20/c1-9-19(37)23(41)27(45)30(48-9)47-8-17-21(39)24(42)29(52-31-26(44)20(38)15(36)7-46-31)32(51-17)49-11-5-14(35)18-16(6-11)50-28(25(43)22(18)40)10-2-3-12(33)13(34)4-10/h2-6,9,15,17,19-21,23-24,26-27,29-39,41-45H,7-8H2,1H3/t9-,15+,17+,19-,20-,21+,23+,24-,26+,27+,29+,30+,31-,32+/m0/s1 > C1C=C(O)C(O)=CC=1C1=C(O)C(=O)C2C(O)=CC(O[C@H]3[C@H](O[C@H]4[C@H](O)[C@@H](O)[C@H](O)CO4)[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)=CC=2O1 > - > - > - > - > - > - > 10533045 > - > - > - > - > - > 33090 > - $$$$