Glycoside
GD101038
Name:
NoneFormula:
C20H22O7N6Smiles:
CCOC(=O)c1ccc(NC(=O)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
CCOC(=O)c1ccc(NC(=O)Nc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 6 |
| MolWt: | 458.43 | Num_heavy_atoms: | 33 |
| TPSA: | 180.95 | NumAromaticRings: | 3 |
Unique Aglycone
AD42708
Formula: C15H13O3N6
Smiles:
CCOC(=O)c1ccc(NC(=O)Nc2ncnc3c2N=C[N]3)cc1| HBA: | 9 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 2.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 325.31 | Num_heavy_atoms: | 24 |
| TPSA: | 119.67 | NumAromaticRings: | 2 |
