LMPK12111719 LIPID_MAPS_STRUCTURE_DATABASE 58 63 0 0 0 0 0 0 0 0999 V2000 11.2336 11.8312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2336 10.7598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1615 10.2241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0891 10.7598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0891 11.8312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1615 12.3668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0169 10.2241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9447 10.7598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9447 11.8312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0169 12.3668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0169 9.4524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8720 12.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8176 11.8206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7632 12.3667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7632 13.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8176 14.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8720 13.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3062 12.3667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7085 14.0042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6022 10.1113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1615 9.4311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1615 13.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2339 13.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2339 15.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1615 15.5795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3066 15.5795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2926 10.4460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6222 9.4975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9705 10.4694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6425 12.3785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2476 11.7742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4736 11.8923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4667 10.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6289 10.4577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8031 10.9438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8100 11.9040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9842 12.3901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1676 8.9985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9866 7.0861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2430 6.2906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6382 8.7551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5131 9.1572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2958 8.6008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2038 7.6423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3320 7.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5493 7.8011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6774 7.4034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6477 10.2226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4481 9.5527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7651 7.6627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2280 7.7164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.2303 6.2702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0661 8.6655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8061 9.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7081 8.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8666 7.9957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1266 7.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2851 6.4386 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 6 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 31 37 1 0 0 0 36 30 1 0 0 0 30 32 1 0 0 0 32 33 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 36 37 1 1 0 0 32 18 1 1 0 0 33 27 1 6 0 0 34 28 1 1 0 0 35 29 1 6 0 0 46 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 0 0 0 45 46 1 0 0 0 46 47 1 6 0 0 42 20 1 1 0 0 43 38 1 6 0 0 44 39 1 6 0 0 45 40 1 1 0 0 52 58 1 0 0 0 57 51 1 0 0 0 51 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 0 0 0 56 57 1 0 0 0 57 58 1 1 0 0 53 38 1 1 0 0 54 48 1 6 0 0 55 49 1 1 0 0 56 50 1 6 0 0 M END > LMPK12111719 > Ikarisoside C > 3-[2-O-beta-D-Glucopyranosyl-6-deoxy-alpha-L-mannopyranosyloxy]-7-(beta-D-glucopyranosyloxy)-8-(3-methyl-2-butenyl)-4',5-dihydroxyflavone > C38H48O20 > 824.27 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > WCUYANMOZSMFCP-FGDCQGOKSA-N > InChI=1S/C38H48O20/c1-13(2)4-9-17-19(53-36-30(50)27(47)24(44)20(11-39)54-36)10-18(42)22-26(46)34(32(56-33(17)22)15-5-7-16(41)8-6-15)57-38-35(29(49)23(43)14(3)52-38)58-37-31(51)28(48)25(45)21(12-40)55-37/h4-8,10,14,20-21,23-25,27-31,35-45,47-51H,9,11-12H2,1-3H3/t14-,20+,21+,23-,24+,25+,27-,28-,29+,30+,31+,35+,36+,37-,38-/m0/s1 > C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C(C/C=C(/C)\C)C2OC(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](CO)O4)[C@H](O)[C@@H](O)[C@H](C)O3)C(=O)C=2C(O)=C1 > - > - > 197236 > - > - > - > 13964057 > - > - > - > - > - > 33090; 244027 > - $$$$