Glycoside
GD039147
Name:
glycyl-adenosine-5'-phosphateFormula:
C12H17O8N6PSmiles:
Nc1ncnc2c1ncn2[C@H]1O[C@H](CO[P@](=O)([O-])OC(=O)C[NH3+])[C@H](O)[C@@H]1OAglycone:
COP(=O)([O-])OC(=O)C[NH3+].Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -3.7 | Num_rotatable_bonds: | 6 |
| MolWt: | 404.28 | Num_heavy_atoms: | 27 |
| TPSA: | 222.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD24293
Formula: C3H8O5NP
Smiles:
COP(=O)([O-])OC(=O)C[NH3+]| HBA: | 6 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | -2.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 169.07 | Num_heavy_atoms: | 10 |
| TPSA: | 103.3 | NumAromaticRings: | 0 |
