LMPK12113176 LIPID_MAPS_STRUCTURE_DATABASE 46 50 0 0 0 999 V2000 8.5561 9.6707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5561 8.5773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5030 8.0307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4498 8.5773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4498 9.6707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5030 10.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3967 8.0307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3433 8.5773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3433 9.6707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3967 10.2174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3967 7.1783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5357 10.4278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5006 9.8706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4657 10.4278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4657 11.5421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5006 12.0992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5357 11.5421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5030 6.9378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4986 12.1383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0992 7.8216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5006 13.2132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5032 11.2371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6341 10.2340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8802 9.7987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9069 6.9631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0673 4.9677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4219 3.8359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3554 6.2555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8716 3.7277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1804 6.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0844 6.3972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1633 5.3969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3408 4.8311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4368 5.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6142 4.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5148 12.9775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5280 14.7038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5249 14.6872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0107 12.0933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8570 13.8864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0075 12.0990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5133 12.9691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0223 13.8338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0207 13.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5148 12.9552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5133 12.9469 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 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 3 18 1 0 0 0 0 19 15 1 0 0 0 0 4 3 1 0 0 0 0 20 8 1 0 0 0 0 16 21 1 0 0 0 0 6 22 1 0 0 0 0 1 23 1 0 0 0 0 23 24 1 0 0 0 0 29 35 1 0 0 0 34 28 1 0 0 0 28 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 1 0 0 30 20 1 1 0 0 31 25 1 6 0 0 32 26 1 1 0 0 33 27 1 1 0 0 40 46 1 0 0 0 45 39 1 0 0 0 39 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 45 46 1 1 0 0 41 22 1 1 0 0 42 36 1 6 0 0 43 37 1 1 0 0 44 38 1 6 0 0 M END > LMPK12113176 > Ranupenin 3-galactoside-8-glucoside > > C28H32O18 > 656.16 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > KBQDWASXQOXLHE-SFZQGBCYSA-N > InChI=1S/C28H32O18/c1-41-12-5-11(33)15-18(36)26(46-28-22(40)20(38)17(35)14(7-30)43-28)23(8-2-3-9(31)10(32)4-8)44-25(15)24(12)45-27-21(39)19(37)16(34)13(6-29)42-27/h2-5,13-14,16-17,19-22,27-35,37-40H,6-7H2,1H3/t13-,14-,16-,17+,19+,20+,21-,22-,27+,28+/m1/s1 > C1(OC)=C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C2OC(C3C=C(O)C(O)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 102403071 > - > - > - > - > - > 33090 > - $$$$