LMPK12110444 LIPID_MAPS_STRUCTURE_DATABASE 43 47 0 0 0 999 V2000 12.2378 -5.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3190 -4.6730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4003 -5.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4003 -6.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3190 -6.7945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2378 -6.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4818 -4.6730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5630 -5.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5630 -6.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4818 -6.7945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7328 -4.7240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4818 -7.7454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3190 -7.5302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2430 -4.6231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1615 -5.1535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0803 -4.6231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0803 -3.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1615 -3.0318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2430 -3.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8714 -3.1056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7173 -3.5941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7540 -3.5526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7540 -1.5509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4847 -0.5545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3541 -3.0518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0389 -0.5709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4859 -3.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6194 -3.0545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6207 -2.0511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4860 -1.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3526 -2.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2180 -1.5553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7186 -6.7253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 -7.7138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2569 -6.7009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9991 -4.7117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5036 -5.3414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8651 -5.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8580 -6.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9849 -6.7132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1245 -6.2067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1316 -5.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2711 -4.6996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 1 0 0 0 0 6 1 2 0 0 0 0 3 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 4 1 0 0 0 0 8 11 1 0 0 0 0 10 12 1 0 0 0 0 5 13 2 0 0 0 0 1 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 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 26 32 1 0 0 0 31 25 1 0 0 0 25 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 1 0 0 0 31 32 1 1 0 0 28 22 1 6 0 0 29 23 1 1 0 0 30 24 1 6 0 0 27 7 1 1 0 0 37 43 1 0 0 0 42 36 1 0 0 0 36 38 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 41 1 0 0 0 41 42 1 0 0 0 42 43 1 1 0 0 38 11 1 1 0 0 39 33 1 6 0 0 40 34 1 1 0 0 41 35 1 6 0 0 M END > LMPK12110444 > Cytisoside 7-O-glucoside > > C28H32O15 > 608.17 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > UZDCKPYGVMHOPB-QQUSBYFVSA-N > InChI=1S/C28H32O15/c1-39-11-4-2-10(3-5-11)14-6-12(31)18-13(32)7-15(42-28-25(38)23(36)21(34)17(9-30)43-28)19(26(18)40-14)27-24(37)22(35)20(33)16(8-29)41-27/h2-7,16-17,20-25,27-30,32-38H,8-9H2,1H3/t16-,17-,20-,21-,22+,23+,24-,25-,27+,28-/m1/s1 > C1(C2C=CC(OC)=CC=2)=CC(=O)C2C(O)=CC(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)=C([C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C=2O1 > - > - > - > - > - > - > 101406317 > - > - > - > - > - > 33090 > - $$$$