Glycoside
GD017977
Name:
NoneFormula:
C22H23O11Smiles:
COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1OAglycone:
COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.32 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 5 |
| MolWt: | 463.42 | Num_heavy_atoms: | 33 |
| TPSA: | 180.6 | NumAromaticRings: | 3 |
Unique Aglycone
AD12764
Formula: C16H13O6
Smiles:
COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.06 |
| AlogP: | 3.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 301.27 | Num_heavy_atoms: | 22 |
| TPSA: | 101.45 | NumAromaticRings: | 3 |
