Glycoside
GD010176
Name:
Epi-12-Palmatoside GFormula:
C25H32O10Smiles:
C[C@@]12C[C@H](c3ccoc3)OC(=O)[C@H]1CC[C@]1(CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)C(=O)C=CC[C@@H]12Aglycone:
CC12CC(c3ccoc3)OC(=O)C1CCC1(CO)C(=O)C=CCC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.68 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 5 |
| MolWt: | 492.52 | Num_heavy_atoms: | 35 |
| TPSA: | 155.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD07901
Formula: C19H22O5
Smiles:
CC12CC(c3ccoc3)OC(=O)C1CCC1(CO)C(=O)C=CCC12| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | 2.81 | Num_rotatable_bonds: | 2 |
| MolWt: | 330.38 | Num_heavy_atoms: | 24 |
| TPSA: | 76.74 | NumAromaticRings: | 1 |
