Glycoside
GD068975
Name:
NoneFormula:
C16H19O5N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCCc4ccco4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NCCc2ccco2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 361.36 | Num_heavy_atoms: | 26 |
| TPSA: | 138.69 | NumAromaticRings: | 3 |
Unique Aglycone
AD32683
Formula: C11H10ON5
Smiles:
C1=Nc2c(ncnc2NCCc2ccco2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.18 |
| AlogP: | 1.63 | Num_rotatable_bonds: | 4 |
| MolWt: | 228.23 | Num_heavy_atoms: | 17 |
| TPSA: | 77.41 | NumAromaticRings: | 2 |
