Glycoside
GD131629
Name:
4,5-bis(acetyloxy)-6-(4-ethylphenoxy)-2-(iodomethyl)oxan-3-yl acetateFormula:
C20H25O8ISmiles:
CCc1ccc(OC2OC(CI)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)cc1Aglycone:
CCc1ccc(O)cc1Sugarmoiety:
CC(=O)OC1C(O)OC(CI)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.55 |
| AlogP: | 2.58 | Num_rotatable_bonds: | 7 |
| MolWt: | 520.32 | Num_heavy_atoms: | 29 |
| TPSA: | 97.36 | NumAromaticRings: | 1 |
Unique Aglycone
AD40385
Formula: C8H10O
Smiles:
CCc1ccc(O)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 1.95 | Num_rotatable_bonds: | 1 |
| MolWt: | 122.17 | Num_heavy_atoms: | 9 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
