Glycoside
GD001674
Name:
NoneFormula:
C21H28O11Smiles:
COC(=O)[C@]1(O)C[C@H](O)[C@H](OC(=O)c2ccccc2)[C@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@H]2O)C1Aglycone:
COC(=O)C1(O)CC(O)C(OC(=O)c2ccccc2)C(O)C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.52 | Num_rotatable_bonds: | 5 |
| MolWt: | 456.44 | Num_heavy_atoms: | 32 |
| TPSA: | 172.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD01653
Formula: C15H18O7
Smiles:
COC(=O)C1(O)CC(O)C(OC(=O)c2ccccc2)C(O)C1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 3 |
| MolWt: | 310.3 | Num_heavy_atoms: | 22 |
| TPSA: | 113.29 | NumAromaticRings: | 1 |
