Glycoside
GD054148
Name:
NoneFormula:
C11H19O8NSSmiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)[C@H]1CCCS1(=O)=OAglycone:
NC(=O)C1CCCS1(=O)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.91 |
| AlogP: | -3.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 325.34 | Num_heavy_atoms: | 21 |
| TPSA: | 153.39 | NumAromaticRings: | 0 |
Unique Aglycone
AD27600
Formula: C5H9O3NS
Smiles:
NC(=O)C1CCCS1(=O)=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 1 |
| MolWt: | 163.2 | Num_heavy_atoms: | 10 |
| TPSA: | 77.23 | NumAromaticRings: | 0 |
