Glycoside
GD088202
Name:
NoneFormula:
C20H26O7N4Smiles:
O=C(N[C@@H]1CCc2c(ccc(=O)n2CCn2cccn2)C1)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
NC1CCc2c(ccc(=O)n2CCn2cccn2)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -2.64 | Num_rotatable_bonds: | 9 |
| MolWt: | 434.45 | Num_heavy_atoms: | 31 |
| TPSA: | 166.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD38613
Formula: C14H18ON4
Smiles:
NC1CCc2c(ccc(=O)n2CCn2cccn2)C1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 3 |
| MolWt: | 258.32 | Num_heavy_atoms: | 19 |
| TPSA: | 65.84 | NumAromaticRings: | 2 |
