Glycoside
GD082892
Name:
NoneFormula:
C16H21O9NSSmiles:
COC(=O)/C=C/c1cccc(S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)c1Aglycone:
COC(=O)C=Cc1cccc(S(N)(=O)=O)c1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -2.21 | Num_rotatable_bonds: | 10 |
| MolWt: | 403.41 | Num_heavy_atoms: | 27 |
| TPSA: | 170.46 | NumAromaticRings: | 1 |
Unique Aglycone
AD36994
Formula: C10H11O4NS
Smiles:
COC(=O)C=Cc1cccc(S(N)(=O)=O)c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 241.27 | Num_heavy_atoms: | 16 |
| TPSA: | 86.46 | NumAromaticRings: | 1 |
