Glycoside
GD010253
Name:
NoneFormula:
C21H20O5NClSmiles:
N#Cc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1Aglycone:
N#Cc1ccc(Cc2ccccc2Cl)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 1.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 389.84 | Num_heavy_atoms: | 27 |
| TPSA: | 113.94 | NumAromaticRings: | 2 |
Unique Aglycone
AD07949
Formula: C15H10NCl
Smiles:
N#Cc1ccc(Cc2ccccc2Cl)cc1| HBA: | 1 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.07 |
| AlogP: | 3.8 | Num_rotatable_bonds: | 2 |
| MolWt: | 227.69 | Num_heavy_atoms: | 16 |
| TPSA: | 23.79 | NumAromaticRings: | 2 |
