Glycoside
GD025435
Name:
ROSAVINFormula:
C20H28O10Smiles:
O[C@H]1[C@H](O)CO[C@H](OC[C@@H]2O[C@H](OCC=Cc3ccccc3)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1OAglycone:
OCC=Cc1ccccc1Sugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.6 |
| AlogP: | -2.02 | Num_rotatable_bonds: | 7 |
| MolWt: | 428.43 | Num_heavy_atoms: | 30 |
| TPSA: | 158.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD05536
Formula: C9H10O
Smiles:
OCC=Cc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 2 |
| MolWt: | 134.18 | Num_heavy_atoms: | 10 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
