LMPK12100044 LIPID_MAPS_STRUCTURE_DATABASE 42 46 0 0 0 0 0 0 0 0999 V2000 13.3310 11.9369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2381 12.4606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1449 11.9372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1449 10.8513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0853 10.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0258 10.8513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0258 11.9372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0853 12.4799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3310 10.8900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2381 10.3668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0853 9.2232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1837 8.7028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1837 7.6617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0853 7.1413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9869 7.6617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9869 8.7028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9654 12.4797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0853 6.1009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2418 9.3044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8878 7.1416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6521 12.3291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9375 11.9164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2315 7.4093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5688 6.4494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9111 7.4091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5686 9.3290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1794 8.7080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4027 8.8490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4027 7.8893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5686 7.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7399 7.8891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7399 8.8489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9111 9.3289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4993 6.8152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0197 5.5916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2253 6.2617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5397 8.4309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4421 8.0966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6021 7.1503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8597 6.5379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9625 6.8730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8027 7.8194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 3 1 0 0 0 0 1 9 1 0 0 0 0 9 10 2 0 0 0 0 10 4 1 0 0 0 0 5 11 1 0 0 0 0 11 12 2 0 0 0 0 12 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 11 1 0 0 0 0 7 17 2 0 0 0 0 14 18 1 0 0 0 0 10 19 1 0 0 0 0 15 20 1 0 0 0 0 1 21 1 0 0 0 0 21 22 1 0 0 0 0 27 33 1 0 0 0 32 26 1 0 0 0 26 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 0 0 0 32 33 1 1 0 0 29 23 1 6 0 0 30 24 1 1 0 0 31 25 1 6 0 0 42 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 0 0 0 41 42 1 0 0 0 38 27 1 1 0 0 39 34 1 6 0 0 40 35 1 1 0 0 41 36 1 6 0 0 28 19 1 1 0 0 M END > LMPK12100044 > > 5,3',4'-Trihydroxy-7-methoxy-4-phenylcoumarin 5-O-xylosyl-(1->6)-glucoside > C27H30O15 > 594.16 > Polyketides [PK] > Flavonoids [PK12] > Neoflavonoids [PK1210] > - > > GXDJGKMWLJOJFR-WUSKNVGPSA-N > InChI=1S/C27H30O15/c1-37-11-5-16-20(12(7-19(31)40-16)10-2-3-13(28)14(29)4-10)17(6-11)41-27-25(36)23(34)22(33)18(42-27)9-39-26-24(35)21(32)15(30)8-38-26/h2-7,15,18,21-30,32-36H,8-9H2,1H3/t15-,18-,21+,22-,23+,24-,25-,26+,27-/m1/s1 > C1(OC)C=C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@@H](O)[C@H](O)CO3)O2)C2C(C3C=C(O)C(O)=CC=3)=CC(=O)OC=2C=1 > - > - > - > - > - > - > 14134097 > - > - > - > - > - > 33090; 85718 > - $$$$