Glycoside
GD100536
Name:
NoneFormula:
C19H26O8N5PSmiles:
COc1cc(C)c(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO[PH](O)(O)O)[C@@H](O)[C@H]2O)cc1CAglycone:
CO[PH](O)(O)O.COc1cc(C)c(Nc2ncnc3c2N=C[N]3)cc1CSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 7 |
| MolWt: | 483.42 | Num_heavy_atoms: | 33 |
| TPSA: | 184.47 | 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 |
AD42448
Formula: C14H14ON5
Smiles:
COc1cc(C)c(Nc2ncnc3c2N=C[N]3)cc1C| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.21 |
| AlogP: | 2.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 268.3 | Num_heavy_atoms: | 20 |
| TPSA: | 73.5 | NumAromaticRings: | 2 |
