Glycoside
GD157575
Name:
2-{2-[7-hydroxy-7-(hydroxymethyl)-2-oxabicyclo[2.2.1]heptan-1-yl]ethoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C15H26O9Smiles:
OCC1OC(OCCC23CCC(CO2)C3(O)CO)C(O)C(O)C1OAglycone:
OCCC12CCC(CO1)C2(O)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -2.9 | Num_rotatable_bonds: | 6 |
| MolWt: | 350.36 | Num_heavy_atoms: | 24 |
| TPSA: | 149.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD62286
Formula: C9H16O4
Smiles:
OCCC12CCC(CO1)C2(O)CO| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 3 |
| MolWt: | 188.22 | Num_heavy_atoms: | 13 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
