Glycoside
GD005606
Name:
DIHYDROSYRINGINFormula:
C17H26O9Smiles:
COc1cc(CCCO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1cc(CCCO)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -1.19 | Num_rotatable_bonds: | 8 |
| MolWt: | 374.39 | Num_heavy_atoms: | 26 |
| TPSA: | 138.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD04738
Formula: C11H16O4
Smiles:
COc1cc(CCCO)cc(OC)c1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 5 |
| MolWt: | 212.25 | Num_heavy_atoms: | 15 |
| TPSA: | 58.92 | NumAromaticRings: | 1 |
