Glycoside
GD075680
Name:
NoneFormula:
C14H21O8N2SSmiles:
CS(=O)(=O)N(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)c1ccc(C[NH3+])cc1Aglycone:
CS(=O)(=O)Nc1ccc(C[NH3+])cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.43 |
| AlogP: | -3.63 | Num_rotatable_bonds: | 8 |
| MolWt: | 377.4 | Num_heavy_atoms: | 25 |
| TPSA: | 180.08 | NumAromaticRings: | 1 |
Unique Aglycone
AD35056
Formula: C8H13O2N2S
Smiles:
CS(=O)(=O)Nc1ccc(C[NH3+])cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 201.27 | Num_heavy_atoms: | 13 |
| TPSA: | 73.81 | NumAromaticRings: | 1 |
