Glycoside
GD139072
Name:
1R,4S,5S,7R,10R)-10-Hydroxyguaianol 10-O-BmannopyranosideFormula:
C21H36O6Smiles:
C=C(C)C1CCC(C)(OC2OC(CO)C(O)C(O)C2O)C2CCC(C)C2C1Aglycone:
C=C(C)C1CCC(C)(O)C2CCC(C)C2C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 4 |
| MolWt: | 384.51 | Num_heavy_atoms: | 27 |
| TPSA: | 99.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD56088
Formula: C15H26O
Smiles:
C=C(C)C1CCC(C)(O)C2CCC(C)C2C1| HBA: | 1 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.87 |
| AlogP: | 3.78 | Num_rotatable_bonds: | 1 |
| MolWt: | 222.37 | Num_heavy_atoms: | 16 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
