Glycoside
GD139551
Name:
Urphoside AFormula:
C23H30O14Smiles:
COc1cc(C(=O)OC2C3C=COC(OC4OC(CO)C(O)C(O)C4O)C3C(O)(CO)C2O)ccc1OAglycone:
COc1cc(C(=O)OC2C3C=COC(O)C3C(O)(CO)C2O)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.61 |
| AlogP: | -3.06 | Num_rotatable_bonds: | 7 |
| MolWt: | 530.48 | Num_heavy_atoms: | 37 |
| TPSA: | 225.06 | NumAromaticRings: | 1 |
Unique Aglycone
AD56275
Formula: C17H20O9
Smiles:
COc1cc(C(=O)OC2C3C=COC(O)C3C(O)(CO)C2O)ccc1O| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 368.34 | Num_heavy_atoms: | 26 |
| TPSA: | 145.91 | NumAromaticRings: | 1 |
