Glycoside
GD081895
Name:
NoneFormula:
C19H24O7N4Smiles:
O=C(C(=O)N1Cc2cncn2C[C@H](COc2cccnc2)C1)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
c1cncc(OCC2CNCc3cncn3C2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -2.04 | Num_rotatable_bonds: | 8 |
| MolWt: | 420.42 | Num_heavy_atoms: | 30 |
| TPSA: | 158.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD36789
Formula: C13H16ON4
Smiles:
c1cncc(OCC2CNCc3cncn3C2)c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.38 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 3 |
| MolWt: | 244.3 | Num_heavy_atoms: | 18 |
| TPSA: | 51.97 | NumAromaticRings: | 2 |
