Glycoside
GD038185
Name:
methyl 2-acetamido-2-deoxy-6-o-sulfo-beta-d-glucopyranosideFormula:
C9H17O9NSSmiles:
CO[C@@H]1O[C@H](COS(=O)(=O)O)[C@H](O)[C@H](O)[C@H]1NC(C)=OAglycone:
COS(=O)(=O)OSugarmoiety:
COC1OC(O)C(O)C(O)C1NC(C)=OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.89 |
| AlogP: | -2.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 315.3 | Num_heavy_atoms: | 20 |
| TPSA: | 151.62 | NumAromaticRings: | 0 |
Unique Aglycone
AD00053
Formula: CH4O4S
Smiles:
COS(=O)(=O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.11 | Num_heavy_atoms: | 6 |
| TPSA: | 63.6 | NumAromaticRings: | 0 |
