Glycoside
GD018400
Name:
GLUCOSULFAMIDEFormula:
C13H22O11N2S2Smiles:
O=S(=O)(NCO)c1ccc(NC([C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)S(=O)(=O)O)cc1Aglycone:
O=S(=O)(O)CNc1ccc(S(=O)(=O)NCO)cc1Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.54 |
| AlogP: | -4.02 | Num_rotatable_bonds: | 11 |
| MolWt: | 446.46 | Num_heavy_atoms: | 28 |
| TPSA: | 233.95 | NumAromaticRings: | 1 |
Unique Aglycone
AD12987
Formula: C8H12O6N2S2
Smiles:
O=S(=O)(O)CNc1ccc(S(=O)(=O)NCO)cc1| HBA: | 8 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 6 |
| MolWt: | 296.33 | Num_heavy_atoms: | 18 |
| TPSA: | 132.8 | NumAromaticRings: | 1 |
