Glycoside
GD064675
Name:
NoneFormula:
C14H22O7N2SSmiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2ccccc2N)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
Nc1ccccc1S(=O)(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.57 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 6 |
| MolWt: | 362.4 | Num_heavy_atoms: | 24 |
| TPSA: | 151.34 | NumAromaticRings: | 1 |
Unique Aglycone
AD31125
Formula: C8H12O3N2S
Smiles:
Nc1ccccc1S(=O)(=O)NCCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 4 |
| MolWt: | 216.26 | Num_heavy_atoms: | 14 |
| TPSA: | 92.42 | NumAromaticRings: | 1 |
