Glycoside
GD090617
Name:
NoneFormula:
C20H23O8N3Smiles:
CN1C(=O)COc2cc(Nc3ccc(O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)cc3)cnc21Aglycone:
CN1C(=O)COc2cc(Nc3ccc(O)cc3)cnc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -0.64 | Num_rotatable_bonds: | 5 |
| MolWt: | 433.42 | Num_heavy_atoms: | 31 |
| TPSA: | 153.84 | NumAromaticRings: | 2 |
Unique Aglycone
AD39422
Formula: C14H13O3N3
Smiles:
CN1C(=O)COc2cc(Nc3ccc(O)cc3)cnc21| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 2 |
| MolWt: | 271.28 | Num_heavy_atoms: | 20 |
| TPSA: | 74.69 | NumAromaticRings: | 2 |
