Glycoside
GD092309
Name:
NoneFormula:
C14H20O9N5PSmiles:
C=CCOC(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[PH](O)(O)O)[C@@H](O)[C@@H]1OAglycone:
C=CCOC(=O)Nc1ncnc2c1N=C[N]2.CO[PH](O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.43 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 7 |
| MolWt: | 433.31 | Num_heavy_atoms: | 29 |
| TPSA: | 201.54 | NumAromaticRings: | 2 |
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 |
AD33117
Formula: C9H8O2N5
Smiles:
C=CCOC(=O)Nc1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 218.2 | Num_heavy_atoms: | 16 |
| TPSA: | 90.57 | NumAromaticRings: | 1 |
