Glycoside
GD132802
Name:
Strobopinin 7-GalactosideFormula:
C22H24O9Smiles:
Cc1c(OC2OC(CO)C(O)C(O)C2O)cc2c(c1O)C(=O)CC(c1ccccc1)O2Aglycone:
Cc1c(O)cc2c(c1O)C(=O)CC(c1ccccc1)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | 0.59 | Num_rotatable_bonds: | 4 |
| MolWt: | 432.43 | Num_heavy_atoms: | 31 |
| TPSA: | 145.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD53244
Formula: C16H14O4
Smiles:
Cc1c(O)cc2c(c1O)C(=O)CC(c1ccccc1)O2| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.19 |
| AlogP: | 3.11 | Num_rotatable_bonds: | 1 |
| MolWt: | 270.28 | Num_heavy_atoms: | 20 |
| TPSA: | 66.76 | NumAromaticRings: | 2 |
