Glycoside
GD025802
Name:
AmarisolideFormula:
C26H36O9Smiles:
C[C@@H]1CC[C@@]23COC(=O)C2=C[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C[C@H]3[C@@]1(C)CCc1ccoc1Aglycone:
CC1CCC23COC(=O)C2=CC(O)CC3C1(C)CCc1ccoc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | 1.32 | Num_rotatable_bonds: | 6 |
| MolWt: | 492.57 | Num_heavy_atoms: | 35 |
| TPSA: | 138.82 | NumAromaticRings: | 1 |
Unique Aglycone
AD17074
Formula: C20H26O4
Smiles:
CC1CCC23COC(=O)C2=CC(O)CC3C1(C)CCc1ccoc1| HBA: | 4 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.65 |
| AlogP: | 3.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.42 | Num_heavy_atoms: | 24 |
| TPSA: | 59.67 | NumAromaticRings: | 1 |
