LMPK12112383 LIPID_MAPS_STRUCTURE_DATABASE 66 72 0 0 0 999 V2000 16.7796 15.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8690 16.1059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8690 17.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7796 17.6832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6902 17.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6902 16.1059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9584 15.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0477 16.1059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1370 15.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1370 14.5287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0477 14.0030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9582 14.5287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2265 16.1059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3158 15.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3158 14.5287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2265 14.0030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0477 12.9513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4052 16.1059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8690 14.0030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2265 12.9513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6008 17.6832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7796 18.7347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7026 19.2677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3618 12.6997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0141 10.7284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1367 10.0477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7142 12.6581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6089 10.3338 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6565 13.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4230 12.3594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2475 11.3715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3088 11.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5423 11.6745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6035 11.3342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2801 8.4483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9825 6.9241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0188 7.2873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9756 9.7524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8459 8.3072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9626 9.5727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2983 8.6299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6469 7.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6651 8.0484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3296 8.9911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3477 9.1728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5172 6.4216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2196 4.8975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2559 5.2606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2127 7.7258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0831 6.2806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1998 7.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5353 6.6033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8839 5.8401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9021 6.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5666 6.9644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5847 7.1461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1559 7.7505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4894 5.7767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9490 4.5059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6757 6.8234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4478 7.4640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3856 7.1150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5515 6.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7813 5.4903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8435 5.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0732 5.2038 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 22 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 39 45 1 0 0 0 44 38 1 0 0 0 38 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 0 0 0 44 45 1 1 0 0 40 28 1 1 0 0 41 35 1 6 0 0 42 36 1 1 0 0 43 37 1 6 0 0 50 56 1 0 0 0 55 49 1 0 0 0 49 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 1 0 0 51 39 1 1 0 0 52 46 1 6 0 0 53 47 1 1 0 0 54 48 1 6 0 0 65 60 1 0 0 0 60 61 1 0 0 0 61 62 1 0 0 0 62 63 1 0 0 0 63 64 1 0 0 0 64 65 1 0 0 0 65 66 1 6 0 0 61 35 1 1 0 0 62 57 1 6 0 0 63 58 1 6 0 0 64 59 1 1 0 0 29 19 1 1 0 0 M END > LMPK12112383 > Isorhamnetin 3-rhamnosyl-(1->2)-gentiobiosyl-(1->6)-glucoside > > C40H52O26 > 948.27 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > Quercetin 3'-methyl ether 3-rhamnosyl-(1->2)-gentiobiosyl-(1->6)-glucoside > RLTSFAYAZSBQAN-KWMCMQKHSA-N > InChI=1S/C40H52O26/c1-11-22(45)27(50)32(55)38(60-11)66-36-30(53)25(48)20(9-58-37-31(54)28(51)23(46)18(8-41)62-37)64-40(36)59-10-19-24(47)29(52)33(56)39(63-19)65-35-26(49)21-15(44)6-13(42)7-17(21)61-34(35)12-3-4-14(43)16(5-12)57-2/h3-7,11,18-20,22-25,27-33,36-48,50-56H,8-10H2,1-2H3/t11-,18+,19+,20+,22-,23+,24+,25+,27+,28-,29-,30-,31+,32+,33+,36+,37+,38-,39-,40+/m0/s1 > C1C=C(O)C(OC)=CC=1C1=C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)[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)O2)C(=O)C2C(O)=CC(O)=CC=2O1 > - > - > - > - > - > - > 44259397 > - > - > - > - > - > 33090 > - $$$$