Glycoside
GD137978
Name:
(-)-4-Methoxy-8'-Acetyl Olivil-4-O-Alpha-Arabinopyronosyl-(1-6)-Beta-Gluc+Formula:
C34H46O17Smiles:
COc1ccc(C2OCC(Cc3ccc(OC4OC(COC5OCC(O)C(O)C5O)C(O)C(O)C4O)c(OC)c3)(OC(C)=O)C2CO)cc1OCAglycone:
COc1cc(CC2(OC(C)=O)COC(c3ccc(OC)c(OC)c3)C2CO)ccc1OSugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.62 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 13 |
| MolWt: | 726.73 | Num_heavy_atoms: | 51 |
| TPSA: | 241.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD55715
Formula: C23H28O8
Smiles:
COc1cc(CC2(OC(C)=O)COC(c3ccc(OC)c(OC)c3)C2CO)ccc1O| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 2.64 | Num_rotatable_bonds: | 8 |
| MolWt: | 432.47 | Num_heavy_atoms: | 31 |
| TPSA: | 103.68 | NumAromaticRings: | 2 |
