Glycoside
GD148172
Name:
3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl 2-phenylpropanoateFormula:
C20H28O11Smiles:
CC(C(=O)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)c1ccccc1Aglycone:
CC(C(=O)O)c1ccccc1Sugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.65 |
| AlogP: | -2.4 | Num_rotatable_bonds: | 6 |
| MolWt: | 444.43 | Num_heavy_atoms: | 31 |
| TPSA: | 175.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD53848
Formula: C9H10O2
Smiles:
CC(C(=O)O)c1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 2 |
| MolWt: | 150.18 | Num_heavy_atoms: | 11 |
| TPSA: | 37.3 | NumAromaticRings: | 1 |
