Glycoside
GD149584
Name:
({5-[5-amino-4-(3-carbamoylpropanamido)-1H-imidazol-1-yl]-3,4-dihydroxyoxolan-2-yl}methoxy)phosphonic acidFormula:
C12H20O9N5PSmiles:
N=C(O)CCC(O)=Nc1ncn(C2OC(COP(=O)(O)O)C(O)C2O)c1NAglycone:
COP(=O)(O)O.N=C(O)CCC(O)=NC1=C(N)[N]C=N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.58 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 8 |
| MolWt: | 409.29 | Num_heavy_atoms: | 27 |
| TPSA: | 236.96 | NumAromaticRings: | 1 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD59800
Formula: C7H10O2N5
Smiles:
N=C(O)CCC(O)=NC1=C(N)[N]C=N1| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 196.19 | Num_heavy_atoms: | 14 |
| TPSA: | 129.15 | NumAromaticRings: | 0 |
