Glycoside
GD018702
Name:
NoneFormula:
C11H14O8N5PSmiles:
Nc1ncnc2c1ncn2C1O[C@H](COP(=O)(O)C(=O)O)[C@H](O)[C@H]1OAglycone:
COP(=O)(O)C(=O)O.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | -1.09 | Num_rotatable_bonds: | 5 |
| MolWt: | 375.23 | Num_heavy_atoms: | 25 |
| TPSA: | 203.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD12986
Formula: C2H5O5P
Smiles:
COP(=O)(O)C(=O)O| HBA: | 5 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 2 |
| MolWt: | 140.03 | Num_heavy_atoms: | 8 |
| TPSA: | 83.83 | NumAromaticRings: | 0 |
