Glycoside
GD031767
Name:
NoneFormula:
C25H38O13Smiles:
COC(=O)C1=CO[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@]2(C)[C@H](C)OC(=O)C(C)(C)[C@H](C)OC(=O)C[C@]12CAglycone:
COC(=O)C1=COC(O)C2(C)C(C)OC(=O)C(C)(C)C(C)OC(=O)CC12CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.8 |
| AlogP: | -0.48 | Num_rotatable_bonds: | 4 |
| MolWt: | 546.57 | Num_heavy_atoms: | 38 |
| TPSA: | 187.51 | NumAromaticRings: | 0 |
Unique Aglycone
AD20447
Formula: C19H28O8
Smiles:
COC(=O)C1=COC(O)C2(C)C(C)OC(=O)C(C)(C)C(C)OC(=O)CC12C| HBA: | 8 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.74 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 384.43 | Num_heavy_atoms: | 27 |
| TPSA: | 108.36 | NumAromaticRings: | 0 |
