Glycoside
GD038289
Name:
5'-o-(dihydroxyphosphanyl)-2,8-dimethyladenosineFormula:
C12H18O7N5PSmiles:
Cc1nc(N)c2nc(C)n([C@H]3O[C@H](COP(=O)(O)O)[C@H](O)[C@@H]3O)c2n1Aglycone:
CC1=Nc2c(N)nc(C)nc2[N]1.COP(=O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -1.25 | Num_rotatable_bonds: | 4 |
| MolWt: | 375.28 | Num_heavy_atoms: | 25 |
| TPSA: | 186.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD23947
Formula: C7H8N5
Smiles:
CC1=Nc2c(N)nc(C)nc2[N]1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.18 | Num_heavy_atoms: | 12 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
