Glycoside
GD040133
Name:
seryl adenylateFormula:
C13H19O9N6PSmiles:
Nc1ncnc2c1ncn2[C@H]1O[C@H](COP(=O)(O)OC(=O)[C@@H](N)CO)[C@H](O)[C@@H]1OAglycone:
COP(=O)(O)OC(=O)C(N)CO.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.54 |
| AlogP: | -2.99 | Num_rotatable_bonds: | 7 |
| MolWt: | 434.3 | Num_heavy_atoms: | 29 |
| TPSA: | 238.39 | 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 |
AD24674
Formula: C4H10O6NP
Smiles:
COP(=O)(O)OC(=O)C(N)CO| HBA: | 7 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.75 |
| AlogP: | -1.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 199.1 | Num_heavy_atoms: | 12 |
| TPSA: | 119.08 | NumAromaticRings: | 0 |
