Glycoside
GD079242
Name:
HastatosideFormula:
C17H24O11Smiles:
COC(=O)C1=CO[C@@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H]2[C@@H](C)CC(=O)[C@]12OAglycone:
COC(=O)C1=COC(O)C2C(C)CC(=O)C12OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.76 |
| AlogP: | -2.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 404.37 | Num_heavy_atoms: | 28 |
| TPSA: | 172.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD36292
Formula: C11H14O6
Smiles:
COC(=O)C1=COC(O)C2C(C)CC(=O)C12O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.64 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.23 | Num_heavy_atoms: | 17 |
| TPSA: | 93.06 | NumAromaticRings: | 0 |
