Glycoside
GD100476
Name:
NoneFormula:
C19H25O8N6PSmiles:
CN(C)C(=O)c1ccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO[PH](O)(O)O)[C@@H](O)[C@H]2O)cc1Aglycone:
CN(C)C(=O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1.CO[PH](O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.37 |
| AlogP: | -0.71 | Num_rotatable_bonds: | 7 |
| MolWt: | 496.42 | Num_heavy_atoms: | 34 |
| TPSA: | 195.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD01852
Formula: CH7O4P
Smiles:
CO[PH](O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 114.04 | Num_heavy_atoms: | 6 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
AD37395
Formula: C14H13ON6
Smiles:
CN(C)C(=O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 281.3 | Num_heavy_atoms: | 21 |
| TPSA: | 84.58 | NumAromaticRings: | 2 |
