LMPK12050017 LIPID_MAPS_STRUCTURE_DATABASE 41 45 0 0 0 999 V2000 10.5381 10.0034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4344 9.4859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3307 10.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2266 9.4861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2266 8.4131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1560 7.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0853 8.4131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0853 9.4861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1560 10.0226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4350 8.4514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3307 7.9341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1560 6.8045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0139 7.8769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0139 6.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9021 6.3386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7905 6.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7905 7.8769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9021 8.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6788 6.3386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5245 8.0814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8528 7.1322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2001 8.1048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8732 10.0152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4767 9.4105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7049 9.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6980 8.5678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8596 8.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0333 8.5795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0401 9.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2136 10.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5249 8.2544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1073 9.3457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.8386 8.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.3384 6.4719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.6731 7.2832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4674 6.8839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3905 7.8419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1844 8.3878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0500 7.9754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1269 7.0174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9926 6.6050 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 16 19 1 0 0 0 0 24 30 1 0 0 0 29 23 1 0 0 0 23 25 1 0 0 0 25 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 1 0 0 25 1 1 1 0 0 26 20 1 6 0 0 27 21 1 1 0 0 28 22 1 6 0 0 35 41 1 0 0 0 40 34 1 0 0 0 34 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 1 0 0 36 19 1 1 0 0 37 31 1 6 0 0 38 32 1 1 0 0 39 33 1 6 0 0 M END > LMPK12050017 > Daidzein 7,4'-di-O-glucoside > 7,4'-Dihydroxyisoflavone 7,4'-di-O-glucoside > C27H30O14 > 578.16 > Polyketides [PK] > Flavonoids [PK12] > Isoflavonoids [PK1205] > - > > VWEWSCDQMVNOJP-IPOZFMEPSA-N > InChI=1S/C27H30O14/c28-8-17-20(31)22(33)24(35)26(40-17)38-12-3-1-11(2-4-12)15-10-37-16-7-13(5-6-14(16)19(15)30)39-27-25(36)23(34)21(32)18(9-29)41-27/h1-7,10,17-18,20-29,31-36H,8-9H2/t17-,18-,20-,21-,22+,23+,24-,25-,26-,27-/m1/s1 > O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C1C=CC2C(=O)C(C3C=CC(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)=CC=3)=COC=2C=1 > - > - > - > - > - > - > 171292 > - > - > - > - > - > 33090; 3914 > - $$$$