LMPK12111721 LIPID_MAPS_STRUCTURE_DATABASE 67 73 0 0 0 999 V2000 11.6261 11.3404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6261 10.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5617 9.7199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4971 10.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4971 11.3404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5617 11.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4327 9.7199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3681 10.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3681 11.3404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4327 11.8807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4639 8.6504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3035 11.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2568 11.3298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2104 11.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2104 12.9813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2568 13.5319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3035 12.9813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6908 11.8802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1636 13.5318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4895 9.6042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5617 8.6400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5617 12.9605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6263 13.5004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6263 14.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5617 15.1202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6913 15.1202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7647 8.0745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0800 6.1936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1130 5.8492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1502 8.4933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1380 8.6689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7811 7.9024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4367 6.9600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4533 6.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8101 7.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8265 7.3824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7381 8.4081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0138 6.8656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.3152 4.9947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0537 6.3651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4021 7.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3888 7.4727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0272 6.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6778 5.7634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6912 5.5966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9930 10.0044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0192 9.6709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7484 11.2113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0659 12.4847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5055 12.7465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7064 11.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3575 10.7747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3680 10.6088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7327 11.3790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0816 12.3169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4462 13.0871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3981 8.5792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8663 6.6495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9331 6.1487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7584 8.7872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4391 6.5774 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7289 9.0414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4315 8.3289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1636 7.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1971 7.1117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4946 7.8242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5279 7.5739 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 32 27 1 6 0 0 33 28 1 6 0 0 34 29 1 1 0 0 45 40 1 0 0 0 40 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 41 27 1 1 0 0 42 37 1 6 0 0 43 38 1 1 0 0 44 39 1 6 0 0 31 20 1 1 0 0 50 56 1 0 0 0 55 49 1 0 0 0 49 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 1 0 0 51 18 1 1 0 0 52 46 1 6 0 0 53 47 1 1 0 0 54 48 1 6 0 0 61 67 1 0 0 0 66 60 1 0 0 0 60 62 1 0 0 0 62 63 1 0 0 0 63 64 1 0 0 0 64 65 1 0 0 0 65 66 1 0 0 0 66 67 1 1 0 0 62 46 1 1 0 0 63 57 1 6 0 0 64 58 1 1 0 0 65 59 1 6 0 0 M END > LMPK12111721 > Hexandraside C > > C43H56O24 > 956.32 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > GKVRQPHAMQILQC-LOZZVJFBSA-N > InChI=1S/C43H56O24/c1-14(2)4-9-18-21(61-43-39(32(56)28(52)23(12-45)63-43)67-41-34(58)30(54)27(51)22(11-44)62-41)10-19(47)24-29(53)37(35(64-36(18)24)16-5-7-17(46)8-6-16)65-42-38(31(55)25(49)15(3)60-42)66-40-33(57)26(50)20(48)13-59-40/h4-8,10,15,20,22-23,25-28,30-34,38-52,54-58H,9,11-13H2,1-3H3/t15-,20+,22+,23+,25-,26-,27+,28+,30-,31+,32-,33+,34+,38+,39+,40-,41-,42-,43+/m0/s1 > C1(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)[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)CO4)[C@H](O)[C@@H](O)[C@H](C)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 15694076 > - > - > - > - > - > 33090 > - $$$$