LMPK12111827 LIPID_MAPS_STRUCTURE_DATABASE 75 82 0 0 0 0 0 0 0 0999 V2000 13.9173 12.7451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9173 11.7560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7737 11.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6301 11.7560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6301 12.7451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7737 13.2394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4865 11.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3430 11.7560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3430 12.7451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4865 13.2394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4865 10.4905 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1990 13.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0720 12.7353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9449 13.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9449 14.2471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0720 14.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1990 14.2471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0612 13.2392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.8174 14.7509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1568 11.2602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7737 10.2729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0880 11.6671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0880 10.6128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3437 10.1831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0010 10.0856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0010 9.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9119 8.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9119 7.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7774 7.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6425 7.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6425 8.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7774 9.0072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5080 7.0089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9409 11.8111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0936 13.6340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6741 14.2865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2464 15.1910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1022 13.3720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5245 12.5469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5185 12.6363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0950 13.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6727 14.3727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2492 15.2842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0766 9.9914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0682 9.8300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9289 11.4862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3646 12.5598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8201 13.0469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9391 11.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5070 10.8195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5002 10.7400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9307 11.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3628 12.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7933 13.3058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1064 11.7678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5209 10.3330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9845 8.3958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5965 9.5714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8589 7.3092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8635 10.5454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8381 10.7992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5462 10.0791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2779 9.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3032 8.8568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0350 7.8881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1260 13.5052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.1408 13.4910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.1314 11.7418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6115 10.8846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1114 11.7620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6213 12.6306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6312 12.6222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1263 11.7477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6165 10.8790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1117 10.0044 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 15 19 1 0 0 0 0 8 20 1 0 0 0 0 3 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 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 31 1 0 0 0 0 31 32 2 0 0 0 0 32 27 1 0 0 0 0 30 33 1 0 0 0 0 37 43 1 0 0 0 42 36 1 0 0 0 36 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 1 0 0 40 34 1 1 0 0 41 35 1 6 0 0 48 54 1 0 0 0 53 47 1 0 0 0 47 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 1 0 0 49 34 1 1 0 0 50 44 1 6 0 0 51 45 1 1 0 0 52 46 1 6 0 0 38 18 1 1 0 0 39 22 1 6 0 0 59 65 1 0 0 0 64 58 1 0 0 0 58 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 1 0 0 60 20 1 1 0 0 61 55 1 6 0 0 62 56 1 1 0 0 63 57 1 6 0 0 74 69 1 0 0 0 69 70 1 0 0 0 70 71 1 0 0 0 71 72 1 0 0 0 72 73 1 0 0 0 73 74 1 0 0 0 74 75 1 6 0 0 70 55 1 1 0 0 71 66 1 6 0 0 72 67 1 6 0 0 73 68 1 1 0 0 M END > LMPK12111827 > Kaempferol 3-neohesperidoside-7-(2''-p-coumaryllaminaribioside) > 3,5,7,4'-Tetrahydroxyflavone 3-rhamnosyl-(1->2)-glucoside-7-glucosyl-(1->3)(2"-p-coumarylglucoside) > C48H56O27 > 1064.30 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > OUYDFTJZSVOQJE-QQXREOSWSA-N > InChI=1S/C48H56O27/c1-17-30(56)35(61)38(64)45(66-17)75-43-37(63)32(58)26(15-50)70-47(43)74-42-34(60)29-23(54)12-22(13-24(29)68-40(42)19-5-9-21(53)10-6-19)67-48-44(72-28(55)11-4-18-2-7-20(52)8-3-18)41(33(59)27(16-51)71-48)73-46-39(65)36(62)31(57)25(14-49)69-46/h2-13,17,25-27,30-33,35-39,41,43-54,56-59,61-65H,14-16H2,1H3/b11-4+/t17-,25+,26+,27+,30-,31+,32+,33+,35+,36-,37-,38+,39+,41-,43+,44+,45-,46-,47-,48+/m0/s1 > C1(O[C@H]2[C@H](OC(/C=C/C3C=CC(O)=CC=3)=O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)[C@H](O)[C@@H](CO)O2)=CC2OC(C3C=CC(O)=CC=3)=C(O[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)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 71694456 > - > - > - > - > - > 33090; 4684 > - $$$$