Glycoside
GD116547
Name:
Afzelechin 7-O-Beta-D-ApiofuranosideFormula:
C20H22O9Smiles:
OCC1(O)COC(Oc2cc(O)c3c(c2)OC(c2ccc(O)cc2)C(O)C3)C1OAglycone:
Oc1ccc(C2Oc3cc(O)cc(O)c3CC2O)cc1Sugarmoiety:
OCC1(O)COC(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 406.39 | Num_heavy_atoms: | 29 |
| TPSA: | 149.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD07043
Formula: C15H14O5
Smiles:
Oc1ccc(C2Oc3cc(O)cc(O)c3CC2O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.2 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 1 |
| MolWt: | 274.27 | Num_heavy_atoms: | 20 |
| TPSA: | 90.15 | NumAromaticRings: | 2 |
