Glycoside
GD157195
Name:
4-butoxy-2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]-4-oxobutanoic acidFormula:
C15H20O7Smiles:
CCCCOC(=O)C(O)C(O)(Cc1ccc(O)cc1)C(=O)OAglycone:
Cc1ccc(O)cc1Sugarmoiety:
CCCCOC(=O)C(O)C(O)(O)C(=O)OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 8 |
| MolWt: | 312.32 | Num_heavy_atoms: | 22 |
| TPSA: | 124.29 | NumAromaticRings: | 1 |
Unique Aglycone
AD00732
Formula: C7H8O
Smiles:
Cc1ccc(O)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 0 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
