Glycoside
GD135923
Name:
NoneFormula:
C20H21O9Smiles:
OC1=CC2OC(c3ccc([OH2+])cc3)=C(OC3OCC(O)C(O)C3O)C=C2C(O)=C1Aglycone:
OC1=CC2OC(c3ccc([OH2+])cc3)=C(O)C=C2C(O)=C1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.3 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 3 |
| MolWt: | 405.38 | Num_heavy_atoms: | 29 |
| TPSA: | 151.74 | NumAromaticRings: | 1 |
Unique Aglycone
AD50346
Formula: C15H13O5
Smiles:
OC1=CC2OC(c3ccc([OH2+])cc3)=C(O)C=C2C(O)=C1| HBA: | 5 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.07 |
| AlogP: | 2.57 | Num_rotatable_bonds: | 1 |
| MolWt: | 273.26 | Num_heavy_atoms: | 20 |
| TPSA: | 92.82 | NumAromaticRings: | 1 |
