Glycoside
GD004900
Name:
NoneFormula:
C27H26O4N6Smiles:
OC[C@@H]1OC(n2cnc3c(NCc4cccc5ccccc45)nc(Nc4ccccc4)nc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(nc(Nc3ccccc3)nc2NCc2cccc3ccccc23)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.22 |
| AlogP: | 2.95 | Num_rotatable_bonds: | 7 |
| MolWt: | 498.54 | Num_heavy_atoms: | 37 |
| TPSA: | 137.58 | NumAromaticRings: | 5 |
Unique Aglycone
AD04226
Formula: C22H17N6
Smiles:
C1=Nc2c(nc(Nc3ccccc3)nc2NCc2cccc3ccccc23)[N]1| HBA: | 6 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.05 |
| AlogP: | 4.89 | Num_rotatable_bonds: | 5 |
| MolWt: | 365.42 | Num_heavy_atoms: | 28 |
| TPSA: | 76.3 | NumAromaticRings: | 4 |
