LMPK12111713 LIPID_MAPS_STRUCTURE_DATABASE 47 51 0 0 0 0 0 0 0 0999 V2000 7.5077 11.1411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5077 10.1195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3925 9.6087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2773 10.1195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2773 11.1411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3925 11.6520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1621 9.6087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0469 10.1195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0469 11.1411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1621 11.6520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1621 8.8121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9314 11.6519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8332 11.1313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7347 11.6519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7347 12.6931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8332 13.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9314 12.6931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6233 11.6519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6364 13.2134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6739 9.5010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3925 8.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3925 12.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5081 13.1839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5081 14.2052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3925 14.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6236 14.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3720 8.5045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3579 6.5354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6484 5.5673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8106 8.0300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6682 8.5188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5172 8.0205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5089 7.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6541 6.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8051 7.0478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9503 6.5638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6482 10.0038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5851 9.6480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2415 7.7964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6708 7.3989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9496 6.2954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3383 8.3283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9765 9.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9471 8.8984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2752 7.9726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6371 7.2229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9653 6.2971 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 35 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 0 0 0 34 35 1 0 0 0 35 36 1 6 0 0 31 20 1 1 0 0 32 27 1 6 0 0 33 28 1 6 0 0 34 29 1 1 0 0 41 47 1 0 0 0 46 40 1 0 0 0 40 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 1 0 0 42 27 1 1 0 0 43 37 1 6 0 0 44 38 1 1 0 0 45 39 1 6 0 0 M END > LMPK12111713 > Ikarisoside B > 3-[(2-O-beta-D-Glucopyranosyl-alpha-L-rhamnopyranosyl)oxy]-8-(3-methyl-2-butenyl)-4',5,7-trihydroxyflavone > C32H38O15 > 662.22 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > FWINXQRXURMYOG-RTXMGSRZSA-N > InChI=1S/C32H38O15/c1-12(2)4-9-16-17(35)10-18(36)20-23(39)29(27(45-28(16)20)14-5-7-15(34)8-6-14)46-32-30(25(41)21(37)13(3)43-32)47-31-26(42)24(40)22(38)19(11-33)44-31/h4-8,10,13,19,21-22,24-26,30-38,40-42H,9,11H2,1-3H3/t13-,19+,21-,22+,24-,25+,26+,30+,31-,32-/m0/s1 > C1(O)=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 > - > - > - > - > - > - > 13964056 > - > - > - > - > - > 33090; 244027 > - $$$$