Glycoside
GD058777
Name:
NoneFormula:
C13H16O7N2SSmiles:
N#Cc1ccccc1S(=O)(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
N#Cc1ccccc1S(N)(=O)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -2.36 | Num_rotatable_bonds: | 4 |
| MolWt: | 344.35 | Num_heavy_atoms: | 23 |
| TPSA: | 160.11 | NumAromaticRings: | 1 |
Unique Aglycone
AD29340
Formula: C7H6O2N2S
Smiles:
N#Cc1ccccc1S(N)(=O)=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 1 |
| MolWt: | 182.2 | Num_heavy_atoms: | 12 |
| TPSA: | 83.95 | NumAromaticRings: | 1 |
