Glycoside
GD036721
Name:
NoneFormula:
C33H33O8FSmiles:
C=CCc1ccc(OC(=O)C=Cc2cccc(F)c2)c(-c2cc(CC=C)ccc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
C=CCc1ccc(O)c(-c2cc(CC=C)ccc2OC(=O)C=Cc2cccc(F)c2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.24 |
| AlogP: | 3.75 | Num_rotatable_bonds: | 11 |
| MolWt: | 576.62 | Num_heavy_atoms: | 42 |
| TPSA: | 125.68 | NumAromaticRings: | 3 |
Unique Aglycone
AD23167
Formula: C27H23O3F
Smiles:
C=CCc1ccc(O)c(-c2cc(CC=C)ccc2OC(=O)C=Cc2cccc(F)c2)c1| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 6.27 | Num_rotatable_bonds: | 8 |
| MolWt: | 414.48 | Num_heavy_atoms: | 31 |
| TPSA: | 46.53 | NumAromaticRings: | 3 |
