Glycoside
GD101033
Name:
NoneFormula:
C21H24O7N6Smiles:
CCOC(=O)c1ccc(NC(=O)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2OC)cc1Aglycone:
CCOC(=O)c1ccc(NC(=O)Nc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 7 |
| MolWt: | 472.46 | Num_heavy_atoms: | 34 |
| TPSA: | 169.95 | 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 |
