Glycoside
GD014919
Name:
NoneFormula:
C26H34O8Smiles:
C#C[C@@]1(OC2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@H]4[C@H]3CC[C@]21CAglycone:
C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21CSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.77 |
| AlogP: | 1.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 474.55 | Num_heavy_atoms: | 34 |
| TPSA: | 133.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD10919
Formula: C20H26O2
Smiles:
C#CC1(O)CCC2C3CCC4=CC(=O)CCC4C3CCC21C| HBA: | 2 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 3.49 | Num_rotatable_bonds: | 0 |
| MolWt: | 298.43 | Num_heavy_atoms: | 22 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
