Glycoside
GD027043
Name:
NoneFormula:
C36H46O19Smiles:
COc1cc(C=CC(=O)OC[C@@H]2O[C@H](O[C@@H]3O[C@H](COC(=O)C=Cc4cc(OC)c(OC)c(OC)c4)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)cc(OC)c1OCAglycone:
COC(=O)C=Cc1cc(OC)c(OC)c(OC)c1.COC(=O)C=Cc1cc(OC)c(OC)c(OC)c1Sugarmoiety:
OC1OC(OC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 16 |
| MolWt: | 782.75 | Num_heavy_atoms: | 55 |
| TPSA: | 257.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD17795
Formula: C13H16O5
Smiles:
COC(=O)C=Cc1cc(OC)c(OC)c(OC)c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.31 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 5 |
| MolWt: | 252.27 | Num_heavy_atoms: | 18 |
| TPSA: | 53.99 | NumAromaticRings: | 1 |
