Glycoside
GD061417
Name:
NoneFormula:
C14H19O7NSSmiles:
COC(=O)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
COC(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 4 |
| MolWt: | 345.37 | Num_heavy_atoms: | 23 |
| TPSA: | 128.48 | NumAromaticRings: | 1 |
Unique Aglycone
AD30129
Formula: C8H9O2NS
Smiles:
COC(=O)Nc1ccc(S)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 2.15 | Num_rotatable_bonds: | 1 |
| MolWt: | 183.23 | Num_heavy_atoms: | 12 |
| TPSA: | 38.33 | NumAromaticRings: | 1 |
