Glycoside
GD148447
Name:
(3,4,5,6-tetrahydroxyoxan-2-yl)methyl 4-hydroxy-2-(hydroxymethyl)benzoateFormula:
C14H18O9Smiles:
O=C(OCC1OC(O)C(O)C(O)C1O)c1ccc(O)cc1COAglycone:
COC(=O)c1ccc(O)cc1COSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -2.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 330.29 | Num_heavy_atoms: | 23 |
| TPSA: | 156.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD59403
Formula: C9H10O4
Smiles:
COC(=O)c1ccc(O)cc1CO| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 2 |
| MolWt: | 182.17 | Num_heavy_atoms: | 13 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
