Glycoside
GD149293
Name:
2-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[4-(3-hydroxybutyl)phenoxy]oxane-3,4,5-triolFormula:
C21H32O11Smiles:
CC(O)CCc1ccc(OC2OC(COC3OC(CO)C(O)C3O)C(O)C(O)C2O)cc1Aglycone:
CC(O)CCc1ccc(O)cc1Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.71 |
| AlogP: | -2.36 | Num_rotatable_bonds: | 9 |
| MolWt: | 460.48 | Num_heavy_atoms: | 32 |
| TPSA: | 178.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD04221
Formula: C10H14O2
Smiles:
CC(O)CCc1ccc(O)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 166.22 | Num_heavy_atoms: | 12 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
