Glycoside
GD134742
Name:
Magnolenin CFormula:
C28H36O14Smiles:
COc1cc(C2(O)OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC32)cc(OC)c1OAglycone:
COc1cc(C2OCC3C2COC3(O)c2cc(OC)c(O)c(OC)c2)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.57 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 9 |
| MolWt: | 596.58 | Num_heavy_atoms: | 42 |
| TPSA: | 195.22 | NumAromaticRings: | 2 |
Unique Aglycone
AD54507
Formula: C22H26O9
Smiles:
COc1cc(C2OCC3C2COC3(O)c2cc(OC)c(O)c(OC)c2)cc(OC)c1O| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | 2.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 434.44 | Num_heavy_atoms: | 31 |
| TPSA: | 116.07 | NumAromaticRings: | 2 |
