Glycoside
GD016926
Name:
NoneFormula:
C9H17O6NSSmiles:
CSCC(=O)NC1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1OAglycone:
CSCC(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | -2.73 | Num_rotatable_bonds: | 4 |
| MolWt: | 267.3 | Num_heavy_atoms: | 17 |
| TPSA: | 119.25 | NumAromaticRings: | 0 |
Unique Aglycone
AD12132
Formula: C3H7ONS
Smiles:
CSCC(N)=O| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 2 |
| MolWt: | 105.16 | Num_heavy_atoms: | 6 |
| TPSA: | 43.09 | NumAromaticRings: | 0 |
