Glycoside
GD013141
Name:
NoneFormula:
C15H19O5NSSmiles:
Cc1ccc(N2C(=O)CS[C@H]2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1Aglycone:
Cc1ccc(N2CSCC2=O)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.53 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 325.39 | Num_heavy_atoms: | 22 |
| TPSA: | 90.23 | NumAromaticRings: | 1 |
Unique Aglycone
AD09845
Formula: C10H11ONS
Smiles:
Cc1ccc(N2CSCC2=O)cc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.3 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 1 |
| MolWt: | 193.27 | Num_heavy_atoms: | 13 |
| TPSA: | 20.31 | NumAromaticRings: | 1 |
