Glycoside
GD083365
Name:
NoneFormula:
C14H18O8N5PSmiles:
O[C@H]1[C@H](O)[C@H](n2cnc3c(Nc4ccoc4)ncnc32)O[C@@H]1CO[PH](O)(O)OAglycone:
C1=Nc2c(ncnc2Nc2ccoc2)[N]1.CO[PH](O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.36 |
| AlogP: | -0.81 | Num_rotatable_bonds: | 6 |
| MolWt: | 415.3 | Num_heavy_atoms: | 28 |
| TPSA: | 188.38 | 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 |
AD29856
Formula: C9H6ON5
Smiles:
C1=Nc2c(ncnc2Nc2ccoc2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 2 |
| MolWt: | 200.18 | Num_heavy_atoms: | 15 |
| TPSA: | 77.41 | NumAromaticRings: | 2 |
