Glycoside
GD151412
Name:
(+)-Lyoniresinol 4,4'-Bis-O-Beta-D-GlucopyranosideFormula:
C34H48O18Smiles:
COc1cc(C2c3c(cc(OC)c(OC4OC(CO)C(O)C(O)C4O)c3OC)CC(CO)C2CO)cc(OC)c1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc(C2c3c(cc(OC)c(O)c3OC)CC(CO)C2CO)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 5 |
| HBD: | 10 | FractionCSP3: | 0.65 |
| AlogP: | -3.02 | Num_rotatable_bonds: | 13 |
| MolWt: | 744.74 | Num_heavy_atoms: | 52 |
| TPSA: | 276.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD01165
Formula: C22H28O8
Smiles:
COc1cc(C2c3c(cc(OC)c(O)c3OC)CC(CO)C2CO)cc(OC)c1O| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | 2.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 420.46 | Num_heavy_atoms: | 30 |
| TPSA: | 117.84 | NumAromaticRings: | 2 |
