LMPK12110369 LIPID_MAPS_STRUCTURE_DATABASE 42 46 0 0 0 999 V2000 14.6061 8.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6061 7.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4629 7.3495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3196 7.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3196 8.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4629 9.3278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1763 7.3495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0330 7.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0330 8.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1763 9.3278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1763 6.5782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8893 9.3277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7625 8.8237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6357 9.3277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6357 10.3359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7625 10.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8893 10.3359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7498 9.3277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4629 6.3606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5086 10.8398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2987 7.9705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 7.9669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7454 7.1092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2142 6.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 7.1092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7625 7.1668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2369 6.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7483 7.1092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2369 7.9951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2142 7.9951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 7.1092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8911 7.5198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8958 7.3596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7640 9.0049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1837 10.0715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6559 10.5554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7545 9.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3252 8.3425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3250 8.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7593 9.0862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1886 9.9900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6227 10.8128 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 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 1 18 1 0 0 0 0 3 19 1 0 0 0 0 15 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 24 25 2 0 0 0 0 21 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 25 1 0 0 0 0 23 28 1 0 0 0 0 25 31 1 0 0 0 0 36 42 1 0 0 0 41 35 1 0 0 0 35 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 1 0 0 37 18 1 1 0 0 38 32 1 6 0 0 39 33 1 1 0 0 40 34 1 6 0 0 34 21 1 0 0 0 0 M END > LMPK12110369 > Apigenin 7-(4''-E-p-coumarylglucoside) > > C30H26O12 > 578.14 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > UTUISHMYVAZILQ-BYJCKKJLSA-N > InChI=1S/C30H26O12/c31-14-24-29(42-25(36)10-3-15-1-6-17(32)7-2-15)27(37)28(38)30(41-24)39-19-11-20(34)26-21(35)13-22(40-23(26)12-19)16-4-8-18(33)9-5-16/h1-13,24,27-34,37-38H,14H2/b10-3+/t24-,27-,28-,29-,30-/m1/s1 > C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](OC(=O)/C=C/C3C=CC(O)=CC=3)[C@@H](CO)O2)=CC2OC(C3C=CC(O)=CC=3)=CC(=O)C=2C(O)=C1 > - > - > - > - > - > - > 101321313 > - > - > - > - > - > 33090 > - $$$$