Glycoside
GD092422
Name:
NoneFormula:
C19H29O8NSSmiles:
Cc1c(C)c(S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)c(C)c2c1OC(C)(C)C2Aglycone:
Cc1c(C)c(S(N)(=O)=O)c(C)c2c1OC(C)(C)C2Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.63 |
| AlogP: | -0.75 | Num_rotatable_bonds: | 8 |
| MolWt: | 431.51 | Num_heavy_atoms: | 29 |
| TPSA: | 153.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD40074
Formula: C13H19O3NS
Smiles:
Cc1c(C)c(S(N)(=O)=O)c(C)c2c1OC(C)(C)C2| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | 1.97 | Num_rotatable_bonds: | 1 |
| MolWt: | 269.37 | Num_heavy_atoms: | 18 |
| TPSA: | 69.39 | NumAromaticRings: | 1 |
