LMPK12110748 LIPID_MAPS_STRUCTURE_DATABASE 43 47 0 0 0 999 V2000 8.8125 -3.4045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8125 -4.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7218 -4.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6309 -4.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6309 -3.4045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7218 -2.8795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5404 -4.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4495 -4.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4495 -3.4045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5404 -2.8795 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5404 -5.7978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9038 -2.8797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7218 -6.0286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4596 -2.8461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4175 -3.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3756 -2.8461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3756 -1.7396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4175 -1.1864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4596 -1.7396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1134 -1.1610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3331 -3.3988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7414 -6.4882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0079 -7.4890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2797 -6.4884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0076 -4.4868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5168 -5.1342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8773 -4.9872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8773 -5.9878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0076 -6.4884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1438 -5.9880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1438 -4.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2797 -4.4869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3332 -4.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4675 -7.5012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4532 -9.5028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7155 -10.4868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8639 -7.9834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7356 -7.4867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5986 -7.9932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5901 -8.9965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7213 -9.4883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8583 -8.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9894 -9.4739 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 1 12 1 0 0 0 0 3 13 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 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 14 9 1 0 0 0 0 17 20 1 0 0 0 0 16 21 1 0 0 0 0 26 32 1 0 0 0 31 25 1 0 0 0 25 27 1 0 0 0 27 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 1 0 0 28 22 1 6 0 0 29 23 1 1 0 0 30 24 1 6 0 0 27 2 1 1 0 0 21 33 1 0 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 22 1 1 0 0 39 34 1 6 0 0 40 35 1 6 0 0 41 36 1 1 0 0 M END > LMPK12110748 > Isoscoparin 2''-O-rhamnoside > > C28H32O15 > 608.17 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > IFUKPUNEQISNJS-CMBILWPKSA-N > InChI=1S/C28H32O15/c1-9-20(33)23(36)25(38)28(40-9)43-27-24(37)21(34)17(8-29)42-26(27)19-13(32)7-16-18(22(19)35)12(31)6-14(41-16)10-3-4-11(30)15(5-10)39-2/h3-7,9,17,20-21,23-30,32-38H,8H2,1-2H3/t9-,17+,20-,21+,23+,24-,25+,26-,27+,28-/m0/s1 > C1(O)=CC2OC(C3C=CC(O)=C(OC)C=3)=CC(=O)C=2C(O)=C1[C@H]1[C@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)[C@@H](O)[C@H](O)[C@@H](CO)O1 > - > - > - > - > - > - > 45359851 > - > - > - > - > - > 33090 > - $$$$