Glycoside
GD014464
Name:
NoneFormula:
C20H14O4NCl3SSmiles:
OC[C@@H]1OC(n2c(Cl)c(-c3ccsc3)c3cc(Cl)c(Cl)cc32)[C@H](O)[C@H]1OAglycone:
Clc1cc2[nH]c(Cl)c(-c3ccsc3)c2cc1ClSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 3.94 | Num_rotatable_bonds: | 3 |
| MolWt: | 434.73 | Num_heavy_atoms: | 26 |
| TPSA: | 74.85 | NumAromaticRings: | 3 |
Unique Aglycone
AD10630
Formula: C15H6NCl3S
Smiles:
Clc1cc2[nH]c(Cl)c(-c3ccsc3)c2cc1Cl| HBA: | 1 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 5.86 | Num_rotatable_bonds: | 1 |
| MolWt: | 302.61 | Num_heavy_atoms: | 17 |
| TPSA: | 15.79 | NumAromaticRings: | 3 |
