LMPK12112647 LIPID_MAPS_STRUCTURE_DATABASE 45 49 0 0 0 999 V2000 7.5570 11.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5570 10.8037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3712 10.3337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1854 10.8037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1854 11.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3712 12.2139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9996 10.3337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8137 10.8037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8137 11.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9996 12.2139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9996 9.6008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6276 12.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4574 11.7348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2870 12.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2870 13.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4574 13.6508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6276 13.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3712 9.3939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7677 10.2267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4574 14.6087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1167 13.6508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8203 12.2645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0607 11.8259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9332 13.1795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4939 9.2138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4796 7.2121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7419 6.2281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8903 8.7315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7619 9.2282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6250 8.7218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6165 7.7185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7477 7.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8847 7.7330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0158 7.2410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8538 7.8532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3358 5.9200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4023 5.4020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 6.8159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1792 8.3019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8897 7.5935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6307 6.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6612 6.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9562 7.0756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2152 8.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 8.7491 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 3 4 1 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 8 1 0 0 0 0 16 20 1 0 0 0 0 1 22 1 0 0 0 0 15 21 1 0 0 0 0 22 23 1 0 0 0 0 21 24 1 0 0 0 0 33 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 0 0 0 32 33 1 0 0 0 33 34 1 1 0 0 29 19 1 1 0 0 30 25 1 6 0 0 31 26 1 1 0 0 32 27 1 6 0 0 44 39 1 0 0 0 39 40 1 0 0 0 40 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 6 0 0 40 35 1 1 0 0 41 36 1 6 0 0 42 37 1 6 0 0 43 38 1 1 0 0 34 35 1 0 0 0 M END > LMPK12112647 > Ombuoside > > C29H34O16 > 638.18 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > VVSFMIXQNYRGMG-BDAFLREQSA-N > InChI=1S/C29H34O16/c1-10-19(32)22(35)24(37)28(42-10)41-9-17-20(33)23(36)25(38)29(44-17)45-27-21(34)18-14(31)7-12(39-2)8-16(18)43-26(27)11-4-5-15(40-3)13(30)6-11/h4-8,10,17,19-20,22-25,28-33,35-38H,9H2,1-3H3/t10-,17+,19-,20+,22+,23-,24+,25+,28+,29-/m0/s1 > C1(OC)=CC2OC(C3C=C(O)C(OC)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 10100634 > - > - > - > - > - > 33090 > - $$$$