Glycoside

GD006591
Name:
NoneFormula:
C24H27O9N2ClSSmiles:
Nc1c(OCCCO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cccc1OCc1cc(-c2ccc(Cl)s2)on1Aglycone:
Nc1c(OCCCO)cccc1OCc1cc(-c2ccc(Cl)s2)on1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 4 |
HBD: | 6 | FractionCSP3: | 0.43 |
AlogP: | 1.8 | Num_rotatable_bonds: | 11 |
MolWt: | 542.99 | Num_heavy_atoms: | 36 |
TPSA: | 169.89 | NumAromaticRings: | 3 |
Unique Aglycone
AD05443
Formula: C18H17O4N2ClS
Smiles:
Nc1c(OCCCO)cccc1OCc1cc(-c2ccc(Cl)s2)on1HBA: | 6 | RingCount: | 3 |
HBD: | 3 | FractionCSP3: | 0.24 |
AlogP: | 3.98 | Num_rotatable_bonds: | 8 |
MolWt: | 380.85 | Num_heavy_atoms: | 25 |
TPSA: | 90.74 | NumAromaticRings: | 3 |