Glycoside
GD008546
Name:
NoneFormula:
C20H21O4N6ClSmiles:
CNC(=O)[C@@H]1O[C@H](n2cnc3c(NCc4ccccc4C)nc(Cl)nc32)[C@H](O)[C@H]1OAglycone:
Cc1ccccc1CNc1nc(Cl)nc2c1N=C[N]2Sugarmoiety:
CNC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 5 |
| MolWt: | 432.87 | Num_heavy_atoms: | 30 |
| TPSA: | 134.42 | NumAromaticRings: | 3 |
Unique Aglycone
AD02520
Formula: C14H11N5Cl
Smiles:
Cc1ccccc1CNc1nc(Cl)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.15 |
| AlogP: | 2.96 | Num_rotatable_bonds: | 3 |
| MolWt: | 272.72 | Num_heavy_atoms: | 19 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
