LMPK12112344 LIPID_MAPS_STRUCTURE_DATABASE 45 49 0 0 0 999 V2000 7.4964 9.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4964 8.1265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4360 7.5842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3756 8.1265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3756 9.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4360 9.7541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3150 7.5842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2547 8.1265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2547 9.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3150 9.7541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3150 6.7382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4378 9.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3954 9.4099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3531 9.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3531 11.0685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3954 11.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4378 11.0685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4360 6.7411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2979 11.4865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 9.6525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0046 7.3766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3997 12.3904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1528 12.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1178 12.3195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7492 11.1597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5586 9.1718 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0195 9.9101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6448 7.9146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1125 10.9091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0224 11.3255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8394 10.7431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7440 9.7493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8342 9.3328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7388 8.3389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6521 8.5129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4602 7.6541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6177 5.6633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9889 5.9494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9361 4.2664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9071 6.9494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7308 7.5175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6366 7.0858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7152 6.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8915 5.5224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9702 4.5270 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 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 15 1 0 0 0 0 4 3 1 0 0 0 0 1 20 1 0 0 0 0 21 8 1 0 0 0 0 16 22 1 0 0 0 0 22 23 1 0 0 0 0 28 34 1 0 0 0 33 27 1 0 0 0 27 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 24 1 6 0 0 31 25 1 1 0 0 32 26 1 6 0 0 39 45 1 0 0 0 44 38 1 0 0 0 38 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 1 0 0 40 21 1 1 0 0 41 35 1 6 0 0 42 36 1 1 0 0 43 37 1 6 0 0 M END > LMPK12112344 > Isorhamnetin 3,4'-diglucoside > > C28H32O17 > 640.16 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > VKVBSQRURLRCHO-QDYVESOYSA-N > InChI=1S/C28H32O17/c1-40-13-4-9(2-3-12(13)42-27-23(38)21(36)18(33)15(7-29)43-27)25-26(20(35)17-11(32)5-10(31)6-14(17)41-25)45-28-24(39)22(37)19(34)16(8-30)44-28/h2-6,15-16,18-19,21-24,27-34,36-39H,7-8H2,1H3/t15-,16-,18-,19-,21+,22+,23-,24-,27-,28+/m1/s1 > C1(O)=CC2OC(C3C=C(OC)C(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1 > - > - > 192427 > - > - > - > 11802256 > - > - > - > - > - > 33090 > - $$$$