Glycoside
GD148211
Name:
10-O-E-FeruloylmonotropeinFormula:
C26H30O14Smiles:
COc1cc(C=CC(=O)OCC2(O)C=CC3C(C(=O)O)=COC(OC4OC(CO)C(O)C(O)C4O)C32)ccc1OAglycone:
COc1cc(C=CC(=O)OCC2(O)C=CC3C(C(=O)O)=COC(O)C32)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.46 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 9 |
| MolWt: | 566.51 | Num_heavy_atoms: | 40 |
| TPSA: | 221.9 | NumAromaticRings: | 1 |
Unique Aglycone
AD59318
Formula: C20H20O9
Smiles:
COc1cc(C=CC(=O)OCC2(O)C=CC3C(C(=O)O)=COC(O)C32)ccc1O| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.3 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 6 |
| MolWt: | 404.37 | Num_heavy_atoms: | 29 |
| TPSA: | 142.75 | NumAromaticRings: | 1 |
