Glycoside
GD034701
Name:
NoneFormula:
C20H28O14Smiles:
Cc1cc(O)cc(O)c1C(=O)OC[C@@H]1O[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1OAglycone:
COC(=O)c1c(C)cc(O)cc1OSugarmoiety:
OCC1OC(OC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.65 |
| AlogP: | -3.81 | Num_rotatable_bonds: | 6 |
| MolWt: | 492.43 | Num_heavy_atoms: | 34 |
| TPSA: | 236.06 | NumAromaticRings: | 1 |
Unique Aglycone
AD06784
Formula: C9H10O4
Smiles:
COC(=O)c1c(C)cc(O)cc1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 1 |
| MolWt: | 182.18 | Num_heavy_atoms: | 13 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
