LMPK12120161 LIPID_MAPS_STRUCTURE_DATABASE 41 43 0 0 0 999 V2000 12.9417 8.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9417 7.9191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8418 7.3994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7421 7.9191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7421 8.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8418 9.4784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6417 7.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5395 7.9181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4353 7.4008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3292 7.9168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2041 7.4119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0787 7.9168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0787 8.9270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2041 9.4321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3292 8.9270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6417 6.3630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8418 6.3606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0421 9.4781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9533 9.4319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1537 7.3173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9533 7.4120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0542 7.7605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0525 7.7606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0561 9.4913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5534 10.3607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0563 9.4925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5560 8.6259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5527 8.6273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0546 9.4926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5550 10.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0568 11.2246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3113 6.7947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6042 6.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2772 6.5359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0561 9.4913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5561 8.6253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5561 10.3573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0725 11.0455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4256 11.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4418 11.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7625 12.7496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 2 0 0 0 0 6 1 1 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 11 2 0 0 0 0 11 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 10 1 0 0 0 0 7 16 2 0 0 0 0 3 17 1 0 0 0 0 1 18 1 0 0 0 0 13 19 1 0 0 0 0 20 2 1 0 0 0 0 12 21 1 0 0 0 0 30 25 1 0 0 0 25 26 1 0 0 0 26 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 1 0 0 27 22 1 6 0 0 28 23 1 1 0 0 29 24 1 6 0 0 23 32 1 0 0 0 32 33 2 0 0 0 32 34 1 0 0 0 24 35 1 0 0 0 35 36 1 0 0 0 35 37 2 0 0 0 38 31 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 39 41 2 0 0 0 26 18 1 1 0 0 M END > LMPK12120161 > Okanin 4'-(3'',4'',6''-triacetylglucoside) > > C27H28O14 > 576.15 > Polyketides [PK] > Flavonoids [PK12] > Chalcones and dihydrochalcones [PK1212] > - > > CKEPCIVNAQZGCM-IBLDPMEOSA-N > InChI=1S/C27H28O14/c1-12(28)37-11-21-25(38-13(2)29)26(39-14(3)30)24(36)27(41-21)40-20-9-6-16(22(34)23(20)35)17(31)7-4-15-5-8-18(32)19(33)10-15/h4-10,21,24-27,32-36H,11H2,1-3H3/b7-4+/t21-,24-,25-,26-,27-/m1/s1 > C1(O[C@H]2[C@H](O)[C@@H](OC(C)=O)[C@H](OC(=O)C)[C@@H](COC(=O)C)O2)C=CC(C(=O)/C=C/C2C=CC(O)=C(O)C=2)=C(O)C=1O > - > - > - > - > - > - > 14861259 > - > - > - > - > - > 33090 > - $$$$