Glycoside
GD040507
Name:
3-o-methyl-2-o-sulfo-alpha-l-idopyranuronic acidFormula:
C7H12O10SSmiles:
CO[C@H]1[C@H](OS(=O)(=O)O)[C@H](O)O[C@H](C(=O)O)[C@@H]1OAglycone:
O=S(=O)(O)OSugarmoiety:
COC1C(O)C(O)OC(C(=O)O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.86 |
| AlogP: | -2.65 | Num_rotatable_bonds: | 4 |
| MolWt: | 288.23 | Num_heavy_atoms: | 18 |
| TPSA: | 159.82 | NumAromaticRings: | 0 |
Unique Aglycone
AD00034
Formula: H2O4S
Smiles:
O=S(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 0 |
| MolWt: | 98.08 | Num_heavy_atoms: | 5 |
| TPSA: | 74.6 | NumAromaticRings: | 0 |
