Glycoside
GD152492
Name:
6-O-Beta-D-Apiofuranosyl DaphnogirinFormula:
C24H20O11Smiles:
COc1ccc2ccc(=O)oc2c1-c1cc2cc(OC3OCC(O)(CO)C3O)c(O)cc2oc1=OAglycone:
COc1ccc2ccc(=O)oc2c1-c1cc2cc(O)c(O)cc2oc1=OSugarmoiety:
OCC1(O)COC(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 484.41 | Num_heavy_atoms: | 35 |
| TPSA: | 169.03 | NumAromaticRings: | 4 |
Unique Aglycone
AD50071
Formula: C19H12O7
Smiles:
COc1ccc2ccc(=O)oc2c1-c1cc2cc(O)c(O)cc2oc1=O| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.05 |
| AlogP: | 2.99 | Num_rotatable_bonds: | 2 |
| MolWt: | 352.3 | Num_heavy_atoms: | 26 |
| TPSA: | 110.11 | NumAromaticRings: | 4 |
