Glycoside
GD070138
Name:
NoneFormula:
C15H17O5N2ClSSmiles:
Cc1csc2c(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cc(Cl)nc12Aglycone:
Cc1csc2c(N)cc(Cl)nc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 3 |
| MolWt: | 360.82 | Num_heavy_atoms: | 23 |
| TPSA: | 115.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD33222
Formula: C9H7N2ClS
Smiles:
Cc1csc2c(N)cc(Cl)nc12| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 2.84 | Num_rotatable_bonds: | 0 |
| MolWt: | 198.68 | Num_heavy_atoms: | 12 |
| TPSA: | 38.91 | NumAromaticRings: | 2 |
