Glycoside
GD076512
Name:
NoneFormula:
C13H18O9N2SSmiles:
COC(=O)c1cncc(S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)c1Aglycone:
COC(=O)c1cncc(S(N)(=O)=O)c1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -3.21 | Num_rotatable_bonds: | 9 |
| MolWt: | 378.36 | Num_heavy_atoms: | 25 |
| TPSA: | 183.35 | NumAromaticRings: | 1 |
Unique Aglycone
AD34817
Formula: C7H8O4N2S
Smiles:
COC(=O)c1cncc(S(N)(=O)=O)c1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | -0.48 | Num_rotatable_bonds: | 2 |
| MolWt: | 216.22 | Num_heavy_atoms: | 14 |
| TPSA: | 99.35 | NumAromaticRings: | 1 |
