Glycoside
GD131088
Name:
NoneFormula:
C20H20O10Smiles:
O[C]1C=C(O)C=C2[OH+]C(c3ccc(O)c(O)c3)=C(OC3OCC(O)C(O)C3O)C=C12Aglycone:
OC1=CC(O)C2=CC(O)=C(c3ccc(O)c(O)c3)[OH+]C2=C1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.25 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 420.37 | Num_heavy_atoms: | 30 |
| TPSA: | 172.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD45227
Formula: C15H13O6
Smiles:
OC1=CC(O)C2=CC(O)=C(c3ccc(O)c(O)c3)[OH+]C2=C1| HBA: | 6 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.07 |
| AlogP: | 2.06 | Num_rotatable_bonds: | 1 |
| MolWt: | 289.26 | Num_heavy_atoms: | 21 |
| TPSA: | 113.95 | NumAromaticRings: | 1 |
