Glycoside
GD102565
Name:
NoneFormula:
C21H24O7NFSSmiles:
COc1cc(CC(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)ccc1FAglycone:
COc1cc(CC(=O)Nc2ccc(S)cc2)ccc1FSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 7 |
| MolWt: | 453.49 | Num_heavy_atoms: | 31 |
| TPSA: | 128.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD43414
Formula: C15H14O2NFS
Smiles:
COc1cc(CC(=O)Nc2ccc(S)cc2)ccc1F| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.13 |
| AlogP: | 3.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 291.35 | Num_heavy_atoms: | 20 |
| TPSA: | 38.33 | NumAromaticRings: | 2 |
