Glycoside
GD037452
Name:
NoneFormula:
C18H26O9Smiles:
COC[C@@H]1O[C@H](c2c(O)cc(O)c(C(C)=O)c2O)[C@H](OC)[C@H](OC)[C@H]1OCAglycone:
CC(=O)c1c(O)cc(O)cc1OSugarmoiety:
COCC1OC(O)C(OC)C(OC)C1OCOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.61 |
| AlogP: | 1.14 | Num_rotatable_bonds: | 7 |
| MolWt: | 386.4 | Num_heavy_atoms: | 27 |
| TPSA: | 123.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD05020
Formula: C8H8O4
Smiles:
CC(=O)c1c(O)cc(O)cc1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 1.01 | Num_rotatable_bonds: | 1 |
| MolWt: | 168.15 | Num_heavy_atoms: | 12 |
| TPSA: | 77.76 | NumAromaticRings: | 1 |
