LMPK12111942 LIPID_MAPS_STRUCTURE_DATABASE 43 47 0 0 0 0 0 0 0 0999 V2000 14.7525 15.1174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7525 14.0806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6504 13.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5484 14.0806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5484 15.1174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6504 15.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8548 13.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9569 14.0806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0589 13.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0589 12.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9569 12.0070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8548 12.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1610 14.0806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2631 13.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2631 12.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1610 12.0070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9569 11.1043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3651 14.0806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6167 12.0853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3034 15.5533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1610 11.1278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5646 10.5533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0442 9.6520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6905 9.0057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0766 9.6520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6589 8.9283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6018 8.9283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0833 9.8262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0465 9.8262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5282 8.9283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0465 8.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0833 8.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7228 8.9283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5159 7.1017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5159 6.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0440 10.4549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9620 8.5734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4603 10.6639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3938 11.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0512 10.3440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5520 9.4794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5689 9.6741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6872 8.9801 0.0000 C 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 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 12 19 1 0 0 0 0 5 20 1 0 0 0 0 16 21 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 27 1 0 0 0 0 30 33 1 0 0 0 0 31 34 1 0 0 0 0 34 35 1 0 0 0 0 42 38 1 0 0 0 42 41 1 0 0 0 38 39 1 0 0 0 41 40 1 0 0 0 39 40 1 0 0 0 40 36 1 6 0 0 41 37 1 6 0 0 41 43 1 0 0 0 39 19 1 1 0 0 43 24 1 0 0 0 M END > LMPK12111942 > Kaempferol 3-(5''-feruloylapioside) > > C30H26O13 > 594.14 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > JXONCIVNSCDGQY-COUSOQSRSA-N > InChI=1S/C30H26O13/c1-39-21-10-15(2-8-19(21)33)3-9-23(35)40-13-30(38)14-41-29(28(30)37)43-27-25(36)24-20(34)11-18(32)12-22(24)42-26(27)16-4-6-17(31)7-5-16/h2-12,28-29,31-34,37-38H,13-14H2,1H3/b9-3+/t28-,29-,30+/m0/s1 > C1C=C(O)C=CC=1C1=C(O[C@H]2[C@H](O)[C@](COC(/C=C/C3C=C(OC)C(O)=CC=3)=O)(O)CO2)C(=O)C2C(O)=CC(O)=CC=2O1 > - > - > - > - > - > - > 102445842 > - > - > - > - > - > 33090; 32101 > - $$$$