Glycoside
GD031587
Name:
NoneFormula:
C24H26O13Smiles:
COc1ccc(-c2oc3cc(OCCO)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1OAglycone:
COc1ccc(-c2oc3cc(OCCO)cc(O)c3c(=O)c2O)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.38 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 8 |
| MolWt: | 522.46 | Num_heavy_atoms: | 37 |
| TPSA: | 208.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD16022
Formula: C18H16O8
Smiles:
COc1ccc(-c2oc3cc(OCCO)cc(O)c3c(=O)c2O)cc1O| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.17 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 5 |
| MolWt: | 360.32 | Num_heavy_atoms: | 26 |
| TPSA: | 129.59 | NumAromaticRings: | 3 |
