Glycoside
GD101291
Name:
NoneFormula:
C23H27O7N3Smiles:
COc1ccc(Cn2cc(Nc3ccc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3)cn2)cc1Aglycone:
COc1ccc(Cn2cc(Nc3ccc(O)cc3)cn2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 8 |
| MolWt: | 457.48 | Num_heavy_atoms: | 33 |
| TPSA: | 138.46 | NumAromaticRings: | 3 |
Unique Aglycone
AD42857
Formula: C17H17O2N3
Smiles:
COc1ccc(Cn2cc(Nc3ccc(O)cc3)cn2)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 3.39 | Num_rotatable_bonds: | 5 |
| MolWt: | 295.34 | Num_heavy_atoms: | 22 |
| TPSA: | 59.31 | NumAromaticRings: | 3 |
