Glycoside
GD010050
Name:
NoneFormula:
C17H20O5NSBrSmiles:
Cc1ccc(Cc2sc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nc2Br)cc1Aglycone:
Cc1ccc(Cc2scnc2Br)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | 1.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 430.32 | Num_heavy_atoms: | 25 |
| TPSA: | 103.04 | NumAromaticRings: | 2 |
Unique Aglycone
AD07805
Formula: C11H10NSBr
Smiles:
Cc1ccc(Cc2scnc2Br)cc1| HBA: | 1 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.18 |
| AlogP: | 3.8 | Num_rotatable_bonds: | 2 |
| MolWt: | 268.18 | Num_heavy_atoms: | 14 |
| TPSA: | 12.89 | NumAromaticRings: | 2 |
