Glycoside
GD073063
Name:
NoneFormula:
C18H23O7N3Smiles:
COc1ccccc1Cn1cncc1CNC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
COc1ccccc1Cn1cncc1CNSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -1.8 | Num_rotatable_bonds: | 10 |
| MolWt: | 393.4 | Num_heavy_atoms: | 28 |
| TPSA: | 154.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD33951
Formula: C12H15ON3
Smiles:
COc1ccccc1Cn1cncc1CN| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 217.27 | Num_heavy_atoms: | 16 |
| TPSA: | 53.07 | NumAromaticRings: | 2 |
