LMPK12110439 LIPID_MAPS_STRUCTURE_DATABASE 42 46 0 0 0 999 V2000 12.2046 -3.5988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2858 -3.0684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3671 -3.5988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3671 -4.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2858 -5.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2046 -4.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4486 -3.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5298 -3.5988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5298 -4.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4486 -5.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6996 -3.1194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4486 -6.1409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2858 -5.9256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2098 -3.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1283 -3.5489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0472 -3.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0472 -1.9577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1283 -1.4273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2098 -1.9577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8383 -1.5010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6842 -1.9895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4404 -6.7220 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7069 -7.7228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9787 -6.7222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7067 -4.7206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2158 -5.3680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5763 -5.2210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5763 -6.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7067 -6.7222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8428 -6.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8428 -5.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9787 -4.7207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0405 -9.6962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 -10.9719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6272 -10.2733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9975 -8.0117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9383 -8.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1051 -9.3468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3311 -9.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -9.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2290 -8.6492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2936 -8.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 1 0 0 0 0 6 1 2 0 0 0 0 3 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 4 1 0 0 0 0 8 11 1 0 0 0 0 10 12 1 0 0 0 0 5 13 2 0 0 0 0 1 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 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 17 20 1 0 0 0 0 20 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 9 1 1 0 0 41 36 1 0 0 0 36 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 6 0 0 37 23 1 1 0 0 38 33 1 6 0 0 39 34 1 6 0 0 40 35 1 1 0 0 M END > LMPK12110439 > Isocytisoside 3''-O-alpha-L-rhamnopyranoside > > C28H32O14 > 592.18 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > FVYKQFCLEFLGIJ-HJZUNKDVSA-N > InChI=1S/C28H32O14/c1-10-20(32)23(35)24(36)28(39-10)42-27-21(33)17(9-29)41-26(25(27)37)19-14(31)8-16-18(22(19)34)13(30)7-15(40-16)11-3-5-12(38-2)6-4-11/h3-8,10,17,20-21,23-29,31-37H,9H2,1-2H3/t10-,17+,20-,21+,23+,24+,25-,26-,27-,28-/m0/s1 > C1(C2C=CC(OC)=CC=2)=CC(=O)C2C(O)=C([C@H]3[C@H](O)[C@@H](O[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)[C@H](O)[C@@H](CO)O3)C(O)=CC=2O1 > - > - > - > - > - > - > 21592259 > - > - > - > - > - > 33090 > - $$$$