Glycoside
GD114231
Name:
FaicarFormula:
C10H15O9N4PSmiles:
NC(=O)c1ncn(C2OC(COP(=O)(O)O)C(O)C2O)c1N=COAglycone:
COP(=O)(O)O.NC(=O)C1=C(N=CO)[N]C=N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -2.07 | Num_rotatable_bonds: | 6 |
| MolWt: | 366.22 | Num_heavy_atoms: | 24 |
| TPSA: | 209.95 | 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 |
AD44918
Formula: C5H5O2N4
Smiles:
NC(=O)C1=C(N=CO)[N]C=N1| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 2 |
| MolWt: | 153.12 | Num_heavy_atoms: | 11 |
| TPSA: | 102.14 | NumAromaticRings: | 0 |
