Glycoside
GD009240
Name:
4Beta-[(Beta-D-Glucopyranosyl)Hydroxy]-PinoresinolFormula:
C26H32O12Smiles:
COc1cc([C@@H]2O[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@@H]3[C@H]2CO[C@H]3c2ccc(O)c(OC)c2)ccc1OAglycone:
COc1cc(C2OC(O)C3C(c4ccc(O)c(OC)c4)OCC23)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | 0.33 | Num_rotatable_bonds: | 7 |
| MolWt: | 536.53 | Num_heavy_atoms: | 38 |
| TPSA: | 176.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD07265
Formula: C20H22O7
Smiles:
COc1cc(C2OC(O)C3C(c4ccc(O)c(OC)c4)OCC23)ccc1O| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | 2.51 | Num_rotatable_bonds: | 4 |
| MolWt: | 374.39 | Num_heavy_atoms: | 27 |
| TPSA: | 97.61 | NumAromaticRings: | 2 |
