Glycoside
GD117147
Name:
NoneFormula:
C20H21O10Smiles:
OC1=CC([OH2+])=CC2OC(c3ccc(O)c(O)c3)=C(OC3OCC(O)C(O)C3O)C=C12Aglycone:
OC1=CC([OH2+])=CC2OC(c3ccc(O)c(O)c3)=C(O)C=C12Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.3 |
| AlogP: | -0.39 | Num_rotatable_bonds: | 3 |
| MolWt: | 421.38 | Num_heavy_atoms: | 30 |
| TPSA: | 171.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD45113
Formula: C15H13O6
Smiles:
OC1=CC([OH2+])=CC2OC(c3ccc(O)c(O)c3)=C(O)C=C12| HBA: | 6 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.07 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 1 |
| MolWt: | 289.26 | Num_heavy_atoms: | 21 |
| TPSA: | 113.05 | NumAromaticRings: | 1 |
