Glycoside
GD008113
Name:
NoneFormula:
C12H21O5NSSmiles:
CCCCN1C(=O)CS[C@H]1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CCCCN1CSCC1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.92 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 5 |
| MolWt: | 291.37 | Num_heavy_atoms: | 19 |
| TPSA: | 90.23 | NumAromaticRings: | 0 |
Unique Aglycone
AD06522
Formula: C7H13ONS
Smiles:
CCCCN1CSCC1=O| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.86 |
| AlogP: | 1.32 | Num_rotatable_bonds: | 3 |
| MolWt: | 159.25 | Num_heavy_atoms: | 10 |
| TPSA: | 20.31 | NumAromaticRings: | 0 |
