Glycoside
GD120568
Name:
CaryophyllanFormula:
C14H28O8Smiles:
COC(CC(O)C1(O)CC(O)C(OC)OC1C)C(O)C(C)OAglycone:
COC(CCO)C(O)C(C)OSugarmoiety:
COC1OC(C)C(O)(O)CC1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | -1.63 | Num_rotatable_bonds: | 7 |
| MolWt: | 324.37 | Num_heavy_atoms: | 22 |
| TPSA: | 128.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD48455
Formula: C7H16O4
Smiles:
COC(CCO)C(O)C(C)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 5 |
| MolWt: | 164.2 | Num_heavy_atoms: | 11 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
