Glycoside
GD137387
Name:
Trans-P-Ferulyl Alcohol 4-O-[6-(2-Methyl-3-Hydroxypropionyl)] GlucopyranosideFormula:
C20H28O10Smiles:
COc1cc(C=CCO)ccc1OC1OC(COC(=O)C(C)CO)C(O)C(O)C1OAglycone:
COC(=O)C(C)CO.COc1cc(C=CCO)ccc1OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -0.94 | Num_rotatable_bonds: | 9 |
| MolWt: | 428.43 | Num_heavy_atoms: | 30 |
| TPSA: | 155.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD05908
Formula: C10H12O3
Smiles:
COc1cc(C=CCO)ccc1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 1.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 180.2 | Num_heavy_atoms: | 13 |
| TPSA: | 49.69 | NumAromaticRings: | 1 |
AD48815
Formula: C5H10O3
Smiles:
COC(=O)C(C)CO| HBA: | 3 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 118.13 | Num_heavy_atoms: | 8 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
