LMPK12111720 LIPID_MAPS_STRUCTURE_DATABASE 57 62 0 0 0 999 V2000 11.6161 11.5903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6161 10.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5207 10.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4253 10.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4253 11.5903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5207 12.1126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3299 10.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2345 10.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2345 11.5903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3299 12.1126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3299 9.2091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1386 12.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0606 11.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9825 12.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9825 13.1771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0606 13.7093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1386 13.1771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7117 12.1125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9043 13.7091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8752 9.9136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5207 9.1617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5207 13.1567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6165 13.6789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6165 14.7230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5207 15.2452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7121 15.2452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6976 10.1111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9570 9.1226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2359 10.1355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9781 12.1247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4826 11.4951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8441 11.6182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8370 10.6176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9639 10.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1035 10.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1106 11.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 12.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3992 8.6163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0376 6.6475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1554 5.9802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7515 8.5934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6962 8.9312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4581 8.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2756 7.2960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3345 6.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5726 7.6111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6314 7.2775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3361 9.1205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7413 7.6951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.2084 5.7705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8361 6.9385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1012 7.9061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0696 8.1582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7730 7.4428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5065 6.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5381 6.2285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2716 5.2662 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 1 18 1 0 0 0 0 15 19 1 0 0 0 0 8 20 1 0 0 0 0 3 21 1 0 0 0 0 6 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 31 37 1 0 0 0 36 30 1 0 0 0 30 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 0 0 0 36 37 1 1 0 0 32 18 1 1 0 0 33 27 1 6 0 0 34 28 1 1 0 0 35 29 1 6 0 0 46 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 0 0 0 46 47 1 6 0 0 42 20 1 1 0 0 43 38 1 6 0 0 44 39 1 6 0 0 45 40 1 1 0 0 56 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 0 0 0 56 57 1 6 0 0 52 38 1 1 0 0 53 48 1 6 0 0 54 49 1 6 0 0 55 50 1 1 0 0 M END > LMPK12111720 > Diphylloside B > > C38H48O19 > 808.28 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > ABEPLDYBWOKMCT-KUBBBFTRSA-N > InChI=1S/C38H48O19/c1-13(2)5-10-18-20(53-37-31(50)28(47)25(44)21(12-39)54-37)11-19(41)22-26(45)34(32(55-33(18)22)16-6-8-17(40)9-7-16)56-38-35(29(48)24(43)15(4)52-38)57-36-30(49)27(46)23(42)14(3)51-36/h5-9,11,14-15,21,23-25,27-31,35-44,46-50H,10,12H2,1-4H3/t14-,15-,21+,23-,24-,25+,27+,28-,29+,30+,31+,35+,36-,37+,38-/m0/s1 > C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C(C/C=C(/C)\C)C2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](O[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)[C@H](O)[C@@H](O)[C@H](C)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 25087702 > - > - > - > - > - > 33090 > - $$$$