Glycoside
GD117661
Name:
4,7,7-trimethyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}bicyclo[2.2.1]heptan-2-yl formateFormula:
C17H28O8Smiles:
CC1(C)C2CC(OC3OC(CO)C(O)C(O)C3O)C1(C)CC2OC=OAglycone:
CC1(C)C2CC(O)C1(C)CC2OC=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.94 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 5 |
| MolWt: | 360.4 | Num_heavy_atoms: | 25 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD46946
Formula: C11H18O3
Smiles:
CC1(C)C2CC(O)C1(C)CC2OC=O| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.91 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 198.26 | Num_heavy_atoms: | 14 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
