Glycoside
GD154849
Name:
(-)-Isolariciresinol 3Alpha-O-Beta-Apiofuranosyl-(1-2)-O-Beta-Glucopyrano+Formula:
C31H42O15Smiles:
COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2COC2OC(CO)C(O)C(O)C2OC2OCC(O)(CO)C2O)ccc1OAglycone:
COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2CO)ccc1OSugarmoiety:
OCC1OC(O)C(OC2OCC(O)(CO)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.61 |
| AlogP: | -1.69 | Num_rotatable_bonds: | 11 |
| MolWt: | 654.66 | Num_heavy_atoms: | 46 |
| TPSA: | 237.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD05465
Formula: C20H24O6
Smiles:
COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2CO)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 5 |
| MolWt: | 360.41 | Num_heavy_atoms: | 26 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
