Glycoside
GD004350
Name:
GLUCOSULFAMIDEFormula:
C13H21O11N2S2Smiles:
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: | 8 | FractionCSP3: | 0.54 |
| AlogP: | -4.37 | Num_rotatable_bonds: | 11 |
| MolWt: | 445.45 | Num_heavy_atoms: | 28 |
| TPSA: | 236.78 | NumAromaticRings: | 1 |
Unique Aglycone
AD03810
Formula: C8H11O6N2S2
Smiles:
O=S(=O)([O-])CNc1ccc(S(=O)(=O)NCO)cc1| HBA: | 8 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | -1.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 295.32 | Num_heavy_atoms: | 18 |
| TPSA: | 135.63 | NumAromaticRings: | 1 |
