LMPK12140032 LIPID_MAPS_STRUCTURE_DATABASE 50 56 0 0 0 999 V2000 7.4984 12.4765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3707 12.9853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5024 11.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3797 10.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2522 11.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2476 12.4843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1291 10.9732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0014 11.4820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9969 12.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1201 12.9931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7973 12.9582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6739 12.4566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5467 12.9650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5427 13.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6660 14.4765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7933 13.9681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1291 10.1231 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7327 12.9185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4086 14.4748 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.2543 12.4673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4212 12.9723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6413 12.4596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8172 13.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0073 12.4399 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.3310 11.4831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3408 11.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8365 10.6025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3521 9.7340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3620 9.7461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8563 10.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3606 14.0690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0451 12.1880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7596 10.6597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0886 12.7091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2935 10.1436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7324 13.4786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7178 13.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0597 12.3616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4169 11.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4315 11.7714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7886 11.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5618 15.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9814 13.2955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3586 14.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9034 14.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9223 13.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8747 14.6400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6615 15.2553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.3747 13.7740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3746 13.7740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 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 2 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 6 1 0 0 0 0 9 11 1 6 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 1 18 1 0 0 0 0 14 19 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 22 1 0 0 0 0 25 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 26 1 0 0 0 0 35 41 1 0 0 0 40 34 1 0 0 0 34 36 1 0 0 0 36 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 1 0 0 37 31 1 6 0 0 38 32 1 1 0 0 39 33 1 6 0 0 46 43 1 0 0 0 43 44 1 0 0 0 44 45 1 0 0 0 44 31 1 1 0 0 45 42 1 6 0 0 47 45 1 0 0 0 47 48 1 6 0 0 46 47 1 0 0 0 47 49 1 0 0 0 36 19 1 1 0 0 49 50 1 0 0 0 21 50 1 0 0 0 0 M END > LMPK12140032 > Licorice glycoside E > > C35H35NO14 > 693.21 > Polyketides [PK] > Flavonoids [PK12] > Flavanones [PK1214] > - > > GNJDLKNJCWOSBO-KSIMLUOHSA-N > InChI=1S/C35H35NO14/c37-14-27-28(40)29(41)30(50-34-31(42)35(44,16-46-34)15-45-32(43)22-13-36-23-4-2-1-3-20(22)23)33(49-27)47-19-8-5-17(6-9-19)25-12-24(39)21-10-7-18(38)11-26(21)48-25/h1-11,13,25,27-31,33-34,36-38,40-42,44H,12,14-16H2/t25-,27+,28+,29-,30+,31-,33+,34-,35+/m0/s1 > C1(O)C=CC2C(=O)C[C@@H](C3C=CC(O[C@H]4[C@H](O[C@H]5[C@@H]([C@@](COC(C6C7C=CC=CC=7NC=6)=O)(CO5)O)O)[C@@H](O)[C@H](O)[C@@H](CO)O4)=CC=3)OC=2C=1 > - > - > - > - > - > - > 101938909 > - > - > - > - > - > 33090 > - $$$$