Glycoside
GD139497
Name:
2-({2-hydroxy-6,6-dimethylbicyclo[3.1.1]heptan-2-yl}methoxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H28O7Smiles:
CC1(C)C2CCC(O)(COC3OC(CO)C(O)C(O)C3O)C1C2Aglycone:
CC1(C)C2CCC(O)(CO)C1C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | -1.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 332.39 | Num_heavy_atoms: | 23 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD56249
Formula: C10H18O2
Smiles:
CC1(C)C2CCC(O)(CO)C1C2| HBA: | 2 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 1 |
| MolWt: | 170.25 | Num_heavy_atoms: | 12 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
