Glycoside
GD016649
Name:
NoneFormula:
C15H20O8Smiles:
COc1cc(C(C)=O)cc(OC)c1O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1cc(C(C)=O)cc(OC)c1OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.53 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 328.32 | Num_heavy_atoms: | 23 |
| TPSA: | 114.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD10638
Formula: C10H12O4
Smiles:
COc1cc(C(C)=O)cc(OC)c1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.3 |
| AlogP: | 1.61 | Num_rotatable_bonds: | 3 |
| MolWt: | 196.2 | Num_heavy_atoms: | 14 |
| TPSA: | 55.76 | NumAromaticRings: | 1 |
