Glycoside
GD057473
Name:
NoneFormula:
C14H19O7NSSmiles:
O=C(CCC(=O)c1cccs1)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
NC(=O)CCC(=O)c1cccs1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 6 |
| MolWt: | 345.37 | Num_heavy_atoms: | 23 |
| TPSA: | 136.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD28820
Formula: C8H9O2NS
Smiles:
NC(=O)CCC(=O)c1cccs1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 183.23 | Num_heavy_atoms: | 12 |
| TPSA: | 60.16 | NumAromaticRings: | 1 |
