Glycoside
GD039614
Name:
7-methyl, adenosine-5'-monophosphateFormula:
C11H18O7N5PSmiles:
CN1CN([C@H]2O[C@H](COP(=O)(O)O)[C@H](O)[C@@H]2O)c2ncnc(N)c21Aglycone:
CN1CNc2ncnc(N)c21.COP(=O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.64 |
| AlogP: | -2.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 363.27 | Num_heavy_atoms: | 24 |
| TPSA: | 174.73 | NumAromaticRings: | 1 |
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 |
AD24474
Formula: C6H9N5
Smiles:
CN1CNc2ncnc(N)c21| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 0 |
| MolWt: | 151.17 | Num_heavy_atoms: | 11 |
| TPSA: | 67.07 | NumAromaticRings: | 1 |
