LMPK12112497 LIPID_MAPS_STRUCTURE_DATABASE 46 50 0 0 0 999 V2000 13.9321 13.0678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0539 13.5747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0539 14.5888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9321 15.0957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8101 14.5888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8101 13.5747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1758 13.0678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2977 13.5747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4197 13.0678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4197 12.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2977 11.5470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1758 12.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5416 13.5747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6634 13.0678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6634 12.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5416 11.5470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2977 10.6780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7854 13.5747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1289 11.4490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5416 10.6977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6883 15.0957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9321 16.1095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6433 13.0937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4598 13.5650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6704 16.5358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2470 11.3741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2477 9.6404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2472 7.9122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2458 9.6403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2616 7.7331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7459 10.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7468 10.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2472 9.6403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7469 8.7763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7461 8.7763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2459 7.9122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2641 5.7268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5306 4.7260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8024 5.7267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5304 7.7282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4000 7.2278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4000 6.2272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5304 5.7267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6665 6.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6664 7.2277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8023 7.7281 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 6 23 1 0 0 0 0 23 24 1 0 0 0 0 22 25 1 0 0 0 0 30 36 1 0 0 0 35 29 1 0 0 0 29 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 0 0 0 35 36 1 1 0 0 32 26 1 6 0 0 33 27 1 1 0 0 34 28 1 1 0 0 45 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 0 0 0 45 46 1 6 0 0 44 39 1 1 0 0 42 37 1 6 0 0 43 38 1 6 0 0 41 30 1 1 0 0 31 19 1 1 0 0 M END > LMPK12112497 > Syringetin 3-robinobioside > > C29H34O17 > 654.18 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > Myricetin 3',5'-dimethyl ether 3-robinobioside > BWDMLCWSGGUHGK-RXDVXBFMSA-N > InChI=1S/C29H34O17/c1-9-18(32)22(36)24(38)28(43-9)42-8-16-20(34)23(37)25(39)29(45-16)46-27-21(35)17-12(31)6-11(30)7-13(17)44-26(27)10-4-14(40-2)19(33)15(5-10)41-3/h4-7,9,16,18,20,22-25,28-34,36-39H,8H2,1-3H3/t9-,16+,18-,20-,22+,23-,24+,25+,28+,29-/m0/s1 > C1C(OC)=C(O)C(OC)=CC=1C1=C(O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)O2)C(=O)C2C(O)=CC(O)=CC=2O1 > - > - > - > - > - > - > 5321578 > - > - > - > - > - > 33090 > - $$$$