Glycoside
GD017445
Name:
NoneFormula:
C16H18O5N6Smiles:
NC(=O)c1c(-c2ccc[nH]2)n([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c2ncnc(N)c12Aglycone:
NC(=O)C1=C(c2ccc[nH]2)[N]c2ncnc(N)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.31 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 4 |
| MolWt: | 374.36 | Num_heavy_atoms: | 27 |
| TPSA: | 185.53 | NumAromaticRings: | 3 |
Unique Aglycone
AD12442
Formula: C11H9ON6
Smiles:
NC(=O)C1=C(c2ccc[nH]2)[N]c2ncnc(N)c21| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.0 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 2 |
| MolWt: | 241.23 | Num_heavy_atoms: | 18 |
| TPSA: | 124.78 | NumAromaticRings: | 2 |
