Glycoside
GD013917
Name:
NoneFormula:
C19H23O6NSSmiles:
Cc1cc(-c2ccc(=O)n(C)c2)ccc1S[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
Cc1cc(-c2ccc(=O)n(C)c2)ccc1SSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.25 | Num_rotatable_bonds: | 4 |
| MolWt: | 393.46 | Num_heavy_atoms: | 27 |
| TPSA: | 112.15 | NumAromaticRings: | 2 |
Unique Aglycone
AD10315
Formula: C13H13ONS
Smiles:
Cc1cc(-c2ccc(=O)n(C)c2)ccc1S| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.15 |
| AlogP: | 2.65 | Num_rotatable_bonds: | 1 |
| MolWt: | 231.32 | Num_heavy_atoms: | 16 |
| TPSA: | 22.0 | NumAromaticRings: | 2 |
