Glycoside
GD015027
Name:
NoneFormula:
C14H18O9NS2Smiles:
O=S(=O)([O-])ON=C(Cc1ccccc1)S[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=S(=O)([O-])ON=C(S)Cc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.45 | Num_rotatable_bonds: | 6 |
| MolWt: | 408.43 | Num_heavy_atoms: | 26 |
| TPSA: | 168.94 | NumAromaticRings: | 1 |
Unique Aglycone
AD10985
Formula: C8H8O4NS2
Smiles:
O=S(=O)([O-])ON=C(S)Cc1ccccc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 0.95 | Num_rotatable_bonds: | 4 |
| MolWt: | 246.29 | Num_heavy_atoms: | 15 |
| TPSA: | 78.79 | NumAromaticRings: | 1 |
