LMPK12130011 LIPID_MAPS_STRUCTURE_DATABASE 43 47 0 0 0 999 V2000 14.0737 7.3756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0737 8.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1804 8.9229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2871 8.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2871 7.3756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1804 6.8597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0549 7.0568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6612 7.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0549 8.7259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3938 8.9229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4213 7.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9419 7.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4586 6.9965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4920 6.9965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0084 7.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4920 8.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4586 8.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0400 7.8913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3031 6.1301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0076 9.6796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1804 9.9543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6712 10.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2168 11.6267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4730 10.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9222 11.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8963 11.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3569 10.8203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2778 10.8203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7383 11.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2778 12.4157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3569 12.4157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6586 11.6180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2030 6.9076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3621 6.0650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7171 7.2373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6480 9.0881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4760 8.5013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3806 7.4937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4573 7.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6349 7.6588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7303 8.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9079 9.2526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9130 10.2641 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 1 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 2 1 0 0 0 0 4 10 1 0 0 0 0 8 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 16 1 0 0 0 0 16 17 2 0 0 0 0 17 12 1 0 0 0 0 15 18 1 0 0 0 0 7 19 2 0 0 0 0 16 20 1 0 0 0 0 3 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 26 1 0 0 0 0 29 32 1 0 0 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 1 0 0 37 10 1 1 0 0 38 33 1 6 0 0 39 34 1 1 0 0 40 35 1 6 0 0 42 43 1 0 0 0 43 22 1 0 0 0 0 M END > LMPK12130011 > Maritimetin 6-(6''-p-coumarylglucoside) > 6,7,3',4'-Tetrahydroxyaurone 6- (6''-p-coumarylglucoside) > C30H26O13 > 594.14 > Polyketides [PK] > Flavonoids [PK12] > Aurone flavonoids [PK1213] > - > > JEBDJWVQHWVRFP-JLSFGLERSA-N > InChI=1S/C30H26O13/c31-16-5-1-14(2-6-16)4-10-23(34)40-13-22-25(36)27(38)28(39)30(43-22)42-20-9-7-17-24(35)21(41-29(17)26(20)37)12-15-3-8-18(32)19(33)11-15/h1-12,22,25,27-28,30-33,36-39H,13H2/b10-4+,21-12?/t22-,25-,27+,28-,30-/m1/s1 > C12C(=O)C(=CC3C=C(O)C(O)=CC=3)OC=1C(O)=C(O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(/C=C/C3C=CC(O)=CC=3)=O)O1)C=C2 > - > - > - > - > - > - > 42607746 > - > - > - > - > - > 33090; 42337 > - $$$$