Glycoside
GD035823
Name:
NoneFormula:
C25H28O13Smiles:
COc1ccc(-c2oc3cc(OCCO)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1OCAglycone:
COc1ccc(-c2oc3cc(OCCO)cc(O)c3c(=O)c2O)cc1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 9 |
| MolWt: | 536.49 | Num_heavy_atoms: | 38 |
| TPSA: | 197.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD21485
Formula: C19H18O8
Smiles:
COc1ccc(-c2oc3cc(OCCO)cc(O)c3c(=O)c2O)cc1OC| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.21 |
| AlogP: | 2.26 | Num_rotatable_bonds: | 6 |
| MolWt: | 374.35 | Num_heavy_atoms: | 27 |
| TPSA: | 118.59 | NumAromaticRings: | 3 |
