Glycoside
GD029051
Name:
NoneFormula:
C11H17O8N4PSmiles:
O=P(O)(O)OC[C@@H]1O[C@H](n2cnc3c2N=CNC[C@H]3O)[C@H](O)[C@H]1OAglycone:
COP(=O)(O)O.OC1CNC=NC2=C1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.64 |
| AlogP: | -2.09 | Num_rotatable_bonds: | 4 |
| MolWt: | 364.25 | Num_heavy_atoms: | 24 |
| TPSA: | 178.89 | 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 |
AD03209
Formula: C6H7ON4
Smiles:
OC1CNC=NC2=C1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 151.15 | Num_heavy_atoms: | 11 |
| TPSA: | 71.08 | NumAromaticRings: | 0 |
