Glycoside
GD065472
Name:
NoneFormula:
C14H22O7N2SSmiles:
CN(c1ccccc1N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)S(C)(=O)=OAglycone:
CN(c1ccccc1N)S(C)(=O)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -1.71 | Num_rotatable_bonds: | 5 |
| MolWt: | 362.4 | Num_heavy_atoms: | 24 |
| TPSA: | 139.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD31485
Formula: C8H12O2N2S
Smiles:
CN(c1ccccc1N)S(C)(=O)=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.66 | Num_rotatable_bonds: | 2 |
| MolWt: | 200.26 | Num_heavy_atoms: | 13 |
| TPSA: | 63.4 | NumAromaticRings: | 1 |
