Glycoside
GD028171
Name:
NoneFormula:
C12H17O6NSSmiles:
Cc1ccc(C(=O)N[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)s1Aglycone:
Cc1ccc(C(N)=O)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -1.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 303.34 | Num_heavy_atoms: | 20 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD18442
Formula: C6H7ONS
Smiles:
Cc1ccc(C(N)=O)s1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.16 | Num_rotatable_bonds: | 1 |
| MolWt: | 141.2 | Num_heavy_atoms: | 9 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
