Glycoside
GD098515
Name:
NoneFormula:
C20H23O10NSSmiles:
O=S(=O)(Nc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1)c1ccc2c(c1)OCCO2Aglycone:
O=S(=O)(Nc1ccc(O)cc1)c1ccc2c(c1)OCCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 6 |
| MolWt: | 469.47 | Num_heavy_atoms: | 32 |
| TPSA: | 164.01 | NumAromaticRings: | 2 |
Unique Aglycone
AD41891
Formula: C14H13O5NS
Smiles:
O=S(=O)(Nc1ccc(O)cc1)c1ccc2c(c1)OCCO2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 3 |
| MolWt: | 307.33 | Num_heavy_atoms: | 21 |
| TPSA: | 84.86 | NumAromaticRings: | 2 |
