LMPK12112232 LIPID_MAPS_STRUCTURE_DATABASE 42 46 0 0 0 999 V2000 12.1231 15.2686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1231 14.2313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0212 13.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9197 14.2313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9197 15.2686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0212 15.7873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2246 13.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3262 14.2313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4277 13.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4277 12.6752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3262 12.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2246 12.6752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5295 14.2313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6311 13.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6311 12.6752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5295 12.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3262 11.1192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 14.2313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1231 12.1565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5295 11.1192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6640 15.6985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7101 13.7749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9695 11.3016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1439 9.3075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5067 8.1641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4230 10.5761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2440 11.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1509 10.7299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2370 9.7303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4184 9.1587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5115 9.5816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6928 9.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3947 12.7067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3245 12.1748 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8253 10.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1867 10.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9325 11.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6451 11.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6120 11.4722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8623 10.5057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1497 9.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4001 8.8365 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 16 20 1 0 0 0 0 5 21 1 0 0 0 0 4 22 1 0 0 0 0 31 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 0 0 0 31 32 1 6 0 0 28 23 1 6 0 0 29 24 1 6 0 0 30 25 1 1 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 6 0 0 37 23 1 1 0 0 38 33 1 6 0 0 39 34 1 6 0 0 40 35 1 1 0 0 27 19 1 1 0 0 M END > LMPK12112232 > Horridin (flavone) > > C27H30O15 > 594.16 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > Quercetin 3-rhamnosyl-(1->2)-rhamnoside > SEEGVLYKLLCFTK-AQNZCLFOSA-N > InChI=1S/C27H30O15/c1-8-17(32)20(35)22(37)26(38-8)42-25-21(36)18(33)9(2)39-27(25)41-24-19(34)16-14(31)6-11(28)7-15(16)40-23(24)10-3-4-12(29)13(30)5-10/h3-9,17-18,20-22,25-33,35-37H,1-2H3/t8-,9-,17-,18-,20+,21+,22+,25+,26-,27-/m0/s1 > C1C=C(O)C(O)=CC=1C1=C(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)[C@H](O)[C@@H](O)[C@H](C)O2)C(=O)C2C(O)=CC(O)=CC=2O1 > - > - > - > - > - > - > 10698716 > - > - > - > - > - > 33090 > - $$$$