LMPK12050172 LIPID_MAPS_STRUCTURE_DATABASE 60 66 0 0 0 999 V2000 9.3280 13.2817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0873 12.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9908 13.4086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8939 12.8872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8939 11.8055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8306 11.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7673 11.8055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7675 12.8872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8306 13.4279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0877 11.8446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9908 11.3229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8306 10.3612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7033 11.2652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7033 10.2313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5990 9.7141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4943 10.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4943 11.2652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5990 11.7821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4442 9.7415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9908 10.4130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6967 11.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5564 11.2503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6012 13.5635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4111 12.9683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1125 12.0472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 12.0472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8094 12.9829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3736 12.6802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5446 13.6499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4028 12.0436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4406 12.2294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6244 14.0184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1532 14.6390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7847 15.5405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5656 13.7413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9948 12.9382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0113 13.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6033 13.9271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1742 14.7302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7662 15.6247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4894 10.1865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5629 8.3349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0372 8.0831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1478 9.0822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0948 9.2840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5870 8.4314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9359 7.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4161 7.4617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4908 7.1248 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3051 5.1630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5128 4.3427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9115 5.4840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7913 7.2858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2893 6.8822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5973 6.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5045 5.7336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6055 5.3237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8049 5.8943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8979 6.8753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0973 7.4459 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 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 4 1 0 0 0 0 2 10 1 0 0 0 0 10 11 2 0 0 0 0 11 5 1 0 0 0 0 6 12 2 0 0 0 0 7 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 17 1 0 0 0 0 17 18 2 0 0 0 0 18 13 1 0 0 0 0 19 16 1 0 0 0 0 11 20 1 0 0 0 0 27 23 1 0 0 0 27 26 1 0 0 0 23 24 1 0 0 0 26 25 1 0 0 0 24 25 1 0 0 0 25 21 1 6 0 0 26 22 1 6 0 0 26 28 1 0 0 0 28 29 1 0 0 0 34 40 1 0 0 0 39 33 1 0 0 0 33 35 1 0 0 0 35 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 1 0 0 35 29 1 1 0 0 36 30 1 6 0 0 37 31 1 1 0 0 38 32 1 6 0 0 47 43 1 0 0 0 47 46 1 0 0 0 43 44 1 0 0 0 46 45 1 0 0 0 44 45 1 0 0 0 45 41 1 6 0 0 46 42 1 6 0 0 46 48 1 0 0 0 48 49 1 0 0 0 54 60 1 0 0 0 59 53 1 0 0 0 53 55 1 0 0 0 55 56 1 0 0 0 56 57 1 0 0 0 57 58 1 0 0 0 58 59 1 0 0 0 59 60 1 1 0 0 55 49 1 1 0 0 56 50 1 6 0 0 57 51 1 1 0 0 58 52 1 6 0 0 24 1 1 1 0 0 44 19 1 1 0 0 M END > LMPK12050172 > Genistein 7,4'-bis(O-glucosylapioside) > 5,7,4'-Trihydroxyisoflavone 7,4'-bis (O-glucosylapioside) > C37H46O23 > 858.24 > Polyketides [PK] > Flavonoids [PK12] > Isoflavonoids [PK1205] > - > Sarothamnoside > LOSLKNDENQPHQW-PRQVDKMXSA-N > InChI=1S/C37H46O23/c38-7-20-24(42)26(44)28(46)32(59-20)53-10-36(50)12-55-34(30(36)48)57-15-3-1-14(2-4-15)17-9-52-19-6-16(5-18(40)22(19)23(17)41)58-35-31(49)37(51,13-56-35)11-54-33-29(47)27(45)25(43)21(8-39)60-33/h1-6,9,20-21,24-35,38-40,42-51H,7-8,10-13H2/t20-,21-,24-,25-,26+,27+,28-,29-,30+,31+,32-,33-,34+,35+,36-,37-/m1/s1 > O([C@H]1[C@H](O)[C@](CO[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)(O)CO1)C1C=C(O)C2C(=O)C(C3C=CC(O[C@H]4[C@H](O)[C@](CO[C@H]5[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O5)(O)CO4)=CC=3)=COC=2C=1 > - > - > - > - > - > - > 44257279 > - > - > - > - > - > 33090; 3833 > - $$$$