Glycoside
GD081116
Name:
NoneFormula:
C16H23O9NSSmiles:
COC(=O)CCc1ccc(S(=O)(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cc1Aglycone:
COC(=O)CCc1ccc(S(N)(=O)=O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -2.13 | Num_rotatable_bonds: | 7 |
| MolWt: | 405.43 | Num_heavy_atoms: | 27 |
| TPSA: | 162.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD36575
Formula: C10H13O4NS
Smiles:
COC(=O)CCc1ccc(S(N)(=O)=O)cc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 0.44 | Num_rotatable_bonds: | 4 |
| MolWt: | 243.28 | Num_heavy_atoms: | 16 |
| TPSA: | 86.46 | NumAromaticRings: | 1 |
