Glycoside
GD002904
Name:
NoneFormula:
C26H32O8Smiles:
C#C[C@@]1(O)CC[C@@H]2[C@@H]3CCc4cc(OC5O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]5O)ccc4[C@H]3CC[C@]21CAglycone:
C#CC1(O)CCC2C3CCc4cc(O)ccc4C3CCC21CSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 472.53 | Num_heavy_atoms: | 34 |
| TPSA: | 136.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD02707
Formula: C20H24O2
Smiles:
C#CC1(O)CCC2C3CCc4cc(O)ccc4C3CCC21C| HBA: | 2 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 3.61 | Num_rotatable_bonds: | 0 |
| MolWt: | 296.41 | Num_heavy_atoms: | 22 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
