Glycoside
GD100602
Name:
NoneFormula:
C17H26O8N5PSmiles:
COC1CCC(=Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO[PH](O)(O)O)[C@@H](O)[C@H]2O)CC1Aglycone:
COC1CCC(=Nc2ncnc3c2N=C[N]3)CC1.CO[PH](O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -0.49 | Num_rotatable_bonds: | 6 |
| MolWt: | 459.4 | Num_heavy_atoms: | 31 |
| TPSA: | 184.8 | 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 |
AD42461
Formula: C12H14ON5
Smiles:
COC1CCC(=Nc2ncnc3c2N=C[N]3)CC1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.5 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.28 | Num_heavy_atoms: | 18 |
| TPSA: | 73.83 | NumAromaticRings: | 1 |
