Glycoside
GD083815
Name:
NoneFormula:
C18H26O6N6Smiles:
CCOC(=O)N[C@@H]1CCCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1Aglycone:
CCOC(=O)NC1CCCN(c2ncnc3c2N=C[N]3)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 422.44 | Num_heavy_atoms: | 30 |
| TPSA: | 155.09 | NumAromaticRings: | 2 |
Unique Aglycone
AD37365
Formula: C13H17O2N6
Smiles:
CCOC(=O)NC1CCCN(c2ncnc3c2N=C[N]3)C1| HBA: | 8 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.54 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 3 |
| MolWt: | 289.32 | Num_heavy_atoms: | 21 |
| TPSA: | 93.81 | NumAromaticRings: | 1 |
