Glycoside
GD116378
Name:
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[2-hydroxy-2-(4-hydroxyphenyl)ethoxy]oxane-3,4,5-triolFormula:
C19H28O12Smiles:
OCC1(O)COC(OCC2OC(OCC(O)c3ccc(O)cc3)C(O)C(O)C2O)C1OAglycone:
OCC(O)c1ccc(O)cc1Sugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.68 |
| AlogP: | -3.29 | Num_rotatable_bonds: | 8 |
| MolWt: | 448.42 | Num_heavy_atoms: | 31 |
| TPSA: | 198.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD46202
Formula: C8H10O3
Smiles:
OCC(O)c1ccc(O)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 0.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 154.16 | Num_heavy_atoms: | 11 |
| TPSA: | 60.69 | NumAromaticRings: | 1 |
