Glycoside
GD122058
Name:
(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoateFormula:
C24H30O11Smiles:
CC(O)C(O)(Cc1ccc(O)cc1)C(=O)OCc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1Aglycone:
CC(O)C(O)(Cc1ccc(O)cc1)C(=O)OCc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.46 |
| AlogP: | -1.03 | Num_rotatable_bonds: | 9 |
| MolWt: | 494.49 | Num_heavy_atoms: | 35 |
| TPSA: | 186.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD49165
Formula: C18H20O6
Smiles:
CC(O)C(O)(Cc1ccc(O)cc1)C(=O)OCc1ccc(O)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.28 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 6 |
| MolWt: | 332.35 | Num_heavy_atoms: | 24 |
| TPSA: | 107.22 | NumAromaticRings: | 2 |
