Glycoside
GD064243
Name:
NoneFormula:
C12H19O7NS2Smiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2ccsc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=S(=O)(NCCO)c1ccsc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 6 |
| MolWt: | 353.42 | Num_heavy_atoms: | 22 |
| TPSA: | 125.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD30914
Formula: C6H9O3NS2
Smiles:
O=S(=O)(NCCO)c1ccsc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 207.28 | Num_heavy_atoms: | 12 |
| TPSA: | 66.4 | NumAromaticRings: | 1 |
