| 1 |
HT2LIG000001 |
C[C@H]1O[C@@H]2[C@H](CO1)O[C@@H]([C@H](O)[C@@H]2O)O[C@H]1[C@H]2COC(=O)[C@@H]2[C@H](c2cc(c(O)c(c2)OC)OC)c2cc3c(cc12)OCO3 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 2 |
HT2LIG000002 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](O)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 3 |
HT2LIG000003 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](O)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 4 |
HT2LIG000004 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](N)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 5 |
HT2LIG000005 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](N)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 6 |
HT2LIG000006 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](NCCO)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 7 |
HT2LIG000008 |
CCCN[C@H]1[C@H]2COC(=O)[C@@H]2[C@H](c2cc(OC)c(O)c(OC)c2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 8 |
HT2LIG000009 |
COCCN[C@H]1[C@H]2COC(=O)[C@@H]2[C@H](c2cc(OC)c(O)c(OC)c2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 9 |
HT2LIG000010 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](NCC=C)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 10 |
HT2LIG000011 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](NCC(C)O)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 11 |
HT2LIG000012 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](NC(C)CO)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 12 |
HT2LIG000013 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](NCCCO)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1989,52,3,606 |
| 13 |
HT2LIG000014 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(F)cc2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 14 |
HT2LIG000015 |
COc1cc(cc(O)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(F)cc2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 15 |
HT2LIG000016 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(F)cc2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 16 |
HT2LIG000017 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(cc2)C(F)(F)F)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 17 |
HT2LIG000018 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 18 |
HT2LIG000020 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2cccc(F)c2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 19 |
HT2LIG000021 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccccc2F)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 20 |
HT2LIG000023 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2cc(F)cc(F)c2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 21 |
HT2LIG000024 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2cc(F)cc(F)c2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 22 |
HT2LIG000025 |
COC(=O)c1ccc(N[C@H]2[C@H]3COC(=O)[C@@H]3[C@H](C3=CC(=O)C(=O)C(=C3)OC)c3cc4OCOc4cc23)cc1O |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 23 |
HT2LIG000026 |
COC(=O)c1ccc(N[C@H]2[C@H]3COC(=O)[C@@H]3[C@H](c3cc(OC)c(O)c(OC)c3)c3cc4OCOc4cc23)cc1O |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 24 |
HT2LIG000028 |
COC(=O)c1cccc(N[C@H]2[C@H]3COC(=O)[C@@H]3[C@H](c3cc(O)c(O)c(OC)c3)c3cc4OCOc4cc23)c1 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 25 |
HT2LIG000029 |
COC(=O)c1cccc(N[C@H]2[C@H]3COC(=O)[C@@H]3[C@H](c3cc(OC)c(O)c(OC)c3)c3cc4OCOc4cc23)c1 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 26 |
HT2LIG000031 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2cccc(Br)c2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 27 |
HT2LIG000038 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2cncc3ccccc23)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 28 |
HT2LIG000039 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccccc2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 29 |
HT2LIG000040 |
COc1cc(cc(O)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccccc2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 30 |
HT2LIG000041 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccccc2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 31 |
HT2LIG000042 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(Cl)cc2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 32 |
HT2LIG000046 |
COc1cc(cc(O)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(cc2)C#N)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 33 |
HT2LIG000049 |
COc1cc(cc(O)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(cc2)C(=O)C)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 34 |
HT2LIG000050 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(CC#N)cc2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 35 |
HT2LIG000051 |
COc1cc(cc(O)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(CC#N)cc2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 36 |
HT2LIG000055 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)C(=O)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 37 |
HT2LIG000056 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](O)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 38 |
HT2LIG000059 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](O)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 39 |
HT2LIG000062 |
COC1=CC(=CC(=O)C1=O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(cc2)[N+](=O)[O-])c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 40 |
HT2LIG000063 |
COc1cc(cc(O)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(cc2)[N+](=O)[O-])c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 41 |
HT2LIG000064 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Nc2ccc(cc2)[N+](=O)[O-])c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 42 |
HT2LIG000065 |
CCOC(=O)c1ccc(N[C@H]2[C@H]3COC(=O)[C@@H]3[C@H](C3=CC(=O)C(=O)C(=C3)OC)c3cc4OCOc4cc23)cc1 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 43 |
HT2LIG000066 |
CCOC(=O)c1ccc(N[C@H]2[C@H]3COC(=O)[C@@H]3[C@H](c3cc(OC)c(O)c(OC)c3)c3cc4OCOc4cc23)cc1 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,1992,55,8,1100 |
| 44 |
HT2LIG000101 |
Cc1c2C=CN(Cc2c(C)c2c3ccccc3[nH]c12)C(=O)NCCCCCCNC(=O)C[C@]1(O)CC[C@H]2[C@@H]3CCc4cc(O)ccc4[C@H]3CC[C@]12C |
PDB
| SDF | MOL2 |
J. Med. Chem.,1996,39,17,3367 |
| 45 |
HT2LIG000152 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2C(COC2=O)[C@H](OC(=O)NCCN(C)C)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Med. Chem.,2005,48,2,593 |
| 46 |
HT2LIG000153 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2C(COC2=O)[C@H](OC(=O)N(C)CCN(C)C)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Med. Chem.,2005,48,2,593 |
| 47 |
HT2LIG000154 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2C(COC2=O)[C@H](OC(=O)NCCCN(C)C)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Med. Chem.,2005,48,2,593 |
| 48 |
HT2LIG000156 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2C(COC2=O)[C@H](OC(=O)NCCCN)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Med. Chem.,2005,48,2,593 |
| 49 |
HT2LIG000158 |
COc1cc(cc(OC)c1O)[C@H]1[C@H]2COC(=O)[C@@H]2[C@H](OC(=O)NCCN(C)C)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Med. Chem.,2005,48,2,593 |
| 50 |
HT2LIG000160 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2C(COC2=O)[C@H](OC(=O)NCCN)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Med. Chem.,2005,48,2,593 |
| 51 |
HT2LIG000164 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2C(COC2=O)[C@H](CCN(C)CCN(C)C)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
J. Med. Chem.,2005,48,2,593 |
| 52 |
HT2LIG000348 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=S)O |
PDB
| SDF | MOL2 |
J. Nat. Prod.,2009,72,9,1643 |
| 53 |
HT2LIG000349 |
COc1ccc(cc1)P(=S)(S)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H]4[C@@H](CC[C@@]4(CC[C@@]32C)C(=S)O)C(=C)C)C1(C)C |
PDB
| SDF | MOL2 |
J. Nat. Prod.,2009,72,9,1643 |
| 54 |
HT2LIG000352 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)NCc6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)O |
PDB
| SDF | MOL2 |
J. Nat. Prod.,2009,72,9,1643 |
| 55 |
HT2LIG000353 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)NS(=O)(=O)c6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)NS(=O)(=O)c1ccccc1 |
PDB
| SDF | MOL2 |
J. Nat. Prod.,2009,72,9,1643 |
| 56 |
HT2LIG000354 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)Nc6cccc7ccccc67)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)O |
PDB
| SDF | MOL2 |
J. Nat. Prod.,2009,72,9,1643 |
| 57 |
HT2LIG000355 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)Nc6ccc(cc6)c6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)O |
PDB
| SDF | MOL2 |
J. Nat. Prod.,2009,72,9,1643 |
| 58 |
HT2LIG000356 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)NCC=C)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)O |
PDB
| SDF | MOL2 |
J. Nat. Prod.,2009,72,9,1643 |
| 59 |
HT2LIG000357 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OS(=O)(=O)c6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)O |
PDB
| SDF | MOL2 |
J. Nat. Prod.,2009,72,9,1643 |
| 60 |
HT2LIG000487 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](NC(=O)c2ccc(cc2)C2(N=N2)C(F)(F)F)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
Bioorg. Med. Chem.,2010,18,2,830 |
| 61 |
HT2LIG001081 |
CCCC(C)C(=O)NCC(C)(C)CC1=C(O)C(=O)c2ccccc2C1=O |
PDB
| SDF | MOL2 |
Eur. J. Med. Chem.,2013,60,,271 |
| 62 |
HT2LIG001082 |
CCCCCCCCCCCCCCCC(=O)NCC(C)(C)CC1=C(O)C(=O)c2ccccc2C1=O |
PDB
| SDF | MOL2 |
Eur. J. Med. Chem.,2013,60,,271 |
| 63 |
HT2LIG001083 |
CCCC(C)C(=O)OCC(C)(C)CC1=C(O)C(=O)c2ccccc2C1=O |
PDB
| SDF | MOL2 |
Eur. J. Med. Chem.,2013,60,,271 |
| 64 |
HT2LIG001084 |
CCCCCCCCCCCCCCCC(=O)OCC(C)(C)CC1=C(O)C(=O)c2ccccc2C1=O |
PDB
| SDF | MOL2 |
Eur. J. Med. Chem.,2013,60,,271 |
| 65 |
HT2LIG001204 |
COC(=O)[C@@H]1[C@H](O)[C@H](O)[C@H](O)[C@@H](O1)Oc1c(cc(O)c(c1O)c1ccccc1)c1ccccc1 |
PDB
| SDF | MOL2 |
Bioorg. Med. Chem. Lett.,2014,24,5,1362 |
| 66 |
HT2LIG001205 |
O=C(O)[C@@H]1[C@@H](O)[C@H](O)[C@H](O)[C@H](O1)Oc1cc(c2ccccc2)c(OC)c(O)c1c1ccccc1 |
PDB
| SDF | MOL2 |
Bioorg. Med. Chem. Lett.,2014,24,5,1362 |
| 67 |
HT2LIG001206 |
O=C(O)[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O1)Oc1c(cc(O)c(c1O)c1ccccc1)c1ccccc1 |
PDB
| SDF | MOL2 |
Bioorg. Med. Chem. Lett.,2014,24,5,1362 |
| 68 |
HT2LIG001220 |
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](OC(=O)c2cnccn2)c2cc3OCOc3cc12 |
PDB
| SDF | MOL2 |
Bioorg. Med. Chem.,2014,22,11,2998 |
