aglycones

Molecular_Structure AD id AlogP MolWeight MolFormula Smiles
AD11991 -1.13 130.15 C5H10O2N2 CC(=O)NCCNC=O
AD11992 -0.16 135.13 C6H5ON3 O=C1N=CN=C2CC=NC12
AD11993 6.28 458.73 C30H50O3 C=C(CCC=C(C)C)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC12C
AD11994 -6.13 6057.92 C190H237O116N78P19 COP(=O)(O)OC1CC(n2cnc3c(=O)[nH]c(N)nc32)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cnc3c(N)ncnc32)OC1COP(=O)(O)OC1CC(n2cnc3c(N)ncnc32)OC1COP(=O)(O)OC1CC(n2cnc3c(=O)[nH]c(N)nc32)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cnc3c(=O)[nH]c(N)nc32)OC1COP(=O)(O)OC1CC(n2cnc3c(N)ncnc32)OC1COP(=O)(O)OC1CC(n2cnc3c(=O)[nH]c(N)nc32)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cnc3c(=O)[nH]c(N)nc32)OC1COP(=O)(O)OC1CC(n2cnc3c(N)ncnc32)OC1COP(=O)(O)OC1CC(n2cnc3c(=O)[nH]c(N)nc32)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(O)OC1CC(n2cnc3c(=O)[nH]c(N)nc32)OC1COP(=O)(O)OC1CC(n2ccc(N)nc2=O)OC1COP(=O)(O)OC1CC(n2cnc3c(=O)[nH]c(N)nc32)OC1COP(=O)(O)OC1CC(n2cnc3c(=O)[nH]c(N)nc32)OC1CO
AD11995 -3.29 2120.22 C62H81O47N21P8 Cc1cn(C2CC(OP(=O)(O)OCC3OC(n4cnc5c(=O)[nH]c(N)nc54)CC3OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)CC3OP(=O)(O)OCC3OC(n4cnc5c(=O)[nH]c(N)nc54)CC3OP(=O)(O)OCC3OC(n4cc(C)c(=O)[nH]c4=O)CC3OP(=O)(O)OP(=O)(O)OP(=O)(O)OCC34COCOC(C(n5cc(C)c(=O)[nH]c5=O)O3)C4O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O
AD11996 2.48 171.28 C10H21ON CCCCCCCCCNC=O
AD11997 3.38 544.51 C30H24O10 Oc1ccc(C2Oc3c(c(O)cc4c3C3c5c(O)cc(O)cc5OC(c5ccc(O)cc5)(O4)C3O)CC2O)cc1
AD11998 6.04 518.78 C32H54O5 CC(=O)OC1C(O)CC2(C)C(CCC3(C)C2C(O)CC2C(C(C)(O)CCC=C(C)C)CCC23C)C1(C)C
AD11999 2.88 284.27 C16H12O5 COc1cc2c(=O)c(-c3ccc(O)cc3)coc2cc1O
AD12000 1.94 279.75 C13H10ON3ClS CSC1NC(=O)C(C#N)=C(c2ccc(Cl)cc2)N1