Glycoside
GD114454
Name:
2-({3,3-dimethylbicyclo[2.2.1]heptan-2-yl}methoxy)-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triolFormula:
C22H38O10Smiles:
CC1OC(OCC2OC(OCC3C4CCC(C4)C3(C)C)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
CC1(C)C2CCC(C2)C1COSugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -1.27 | Num_rotatable_bonds: | 6 |
| MolWt: | 462.54 | Num_heavy_atoms: | 32 |
| TPSA: | 158.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD45067
Formula: C10H18O
Smiles:
CC1(C)C2CCC(C2)C1CO| HBA: | 1 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 1 |
| MolWt: | 154.25 | Num_heavy_atoms: | 11 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
