Glycoside
GD048209
Name:
NoneFormula:
C15H20O6N2Smiles:
O=C(Nc1ccc(C2CCC2)nc1)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
Nc1ccc(C2CCC2)nc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 7 |
| MolWt: | 324.33 | Num_heavy_atoms: | 23 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD25830
Formula: C9H12N2
Smiles:
Nc1ccc(C2CCC2)nc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 1 |
| MolWt: | 148.21 | Num_heavy_atoms: | 11 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
