LMPK12120407 LIPID_MAPS_STRUCTURE_DATABASE 42 45 0 0 0 999 V2000 11.7838 9.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7838 8.1129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7200 7.5722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6564 8.1129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6564 9.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7200 9.7345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7200 6.5755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9886 10.3280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4737 9.6658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6183 7.5575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6183 6.6201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6607 7.5575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7987 7.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8041 7.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3446 6.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4258 6.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9663 7.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4258 8.4965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3446 8.4965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7636 7.5604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8387 9.2165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8387 10.0828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9005 8.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 8.7745 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3662 7.7970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1532 7.0556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1013 7.5752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9331 6.3606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6382 7.2324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5794 8.0461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 7.6064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2374 11.0012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5851 12.9724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4625 13.6531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8850 11.0428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9903 13.3671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9427 10.6983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1762 11.3415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3517 12.3293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2904 12.6695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0569 12.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9957 12.3666 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 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 3 7 2 0 0 0 0 6 8 1 0 0 0 0 5 9 1 0 0 0 0 4 10 1 0 0 0 0 10 11 2 0 0 0 0 10 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 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 1 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 23 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 25 30 1 0 0 0 0 30 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 38 32 1 6 0 0 39 33 1 1 0 0 40 34 1 6 0 0 37 6 1 1 0 0 M END > LMPK12120407 > Tinctormine > > C27H31NO14 > 593.17 > Polyketides [PK] > Flavonoids [PK12] > Chalcones and dihydrochalcones [PK1212] > - > > SWPZRXBZBMWKJC-OPEGSKGCSA-N > InChI=1S/C27H31NO14/c29-8-13-20(35)22(37)18(28-13)19(34)12-7-15(33)17(14(32)6-3-10-1-4-11(31)5-2-10)25(40)27(12,41)26-24(39)23(38)21(36)16(9-30)42-26/h1-7,13,16,20-24,26,28-31,34-41H,8-9H2/b6-3?,19-18-/t13?,16-,20?,21-,22?,23+,24-,26-,27?/m1/s1 > C1(/C(=C2\C(O)C(O)C(CO)N\2)/O)C([C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)(O)C(O)=C(C(C=CC2C=CC(O)=CC=2)=O)C(=O)C=1 > - > - > - > - > - > - > 42607657 > - > - > - > - > - > 33090 > - $$$$