Glycoside
GD037501
Name:
NoneFormula:
C29H42O10Smiles:
CCCCCCCC=C[C@@H]1O[C@@]23C(=O)C[C@@]4(C[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)C[C@H]4[C@H]2C=C1C)OC3=OAglycone:
CCCCCCCC=CC1OC23C(=O)CC4(CC(O)CC4C2C=C1C)OC3=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.79 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 10 |
| MolWt: | 550.65 | Num_heavy_atoms: | 39 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD23615
Formula: C23H32O5
Smiles:
CCCCCCCC=CC1OC23C(=O)CC4(CC(O)CC4C2C=C1C)OC3=O| HBA: | 5 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.74 |
| AlogP: | 3.64 | Num_rotatable_bonds: | 7 |
| MolWt: | 388.5 | Num_heavy_atoms: | 28 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
