Glycoside
GD081749
Name:
NoneFormula:
C19H24O6N4Smiles:
O=C(NC1CCN(c2cnc3ccccc3n2)CC1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
NC1CCN(c2cnc3ccccc3n2)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -1.64 | Num_rotatable_bonds: | 7 |
| MolWt: | 404.42 | Num_heavy_atoms: | 29 |
| TPSA: | 156.11 | NumAromaticRings: | 2 |
Unique Aglycone
AD36755
Formula: C13H16N4
Smiles:
NC1CCN(c2cnc3ccccc3n2)CC1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 1 |
| MolWt: | 228.3 | Num_heavy_atoms: | 17 |
| TPSA: | 55.04 | NumAromaticRings: | 2 |
