Glycoside
GD062609
Name:
NoneFormula:
C10H16O8N5PSmiles:
Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@H](O)O[PH](O)(O)O)[C@@H](O)[C@@H]1OAglycone:
Nc1ncnc2c1N=C[N]2.OCO[PH](O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.5 |
| AlogP: | -3.25 | Num_rotatable_bonds: | 4 |
| MolWt: | 365.24 | Num_heavy_atoms: | 24 |
| TPSA: | 209.46 | 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 |
AD30344
Formula: CH7O5P
Smiles:
OCO[PH](O)(O)O| HBA: | 5 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -1.66 | Num_rotatable_bonds: | 2 |
| MolWt: | 130.04 | Num_heavy_atoms: | 7 |
| TPSA: | 90.15 | NumAromaticRings: | 0 |
