Glycoside
GD124409
Name:
4,5-bis(acetyloxy)-2-(iodomethyl)-6-phenoxyoxan-3-yl acetateFormula:
C18H21O8ISmiles:
CC(=O)OC1C(CI)OC(Oc2ccccc2)C(OC(C)=O)C1OC(C)=OAglycone:
Oc1ccccc1Sugarmoiety:
CC(=O)OC1C(O)OC(CI)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.5 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 492.26 | Num_heavy_atoms: | 27 |
| TPSA: | 97.36 | NumAromaticRings: | 1 |
Unique Aglycone
AD01349
Formula: C6H6O
Smiles:
Oc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 0 |
| MolWt: | 94.11 | Num_heavy_atoms: | 7 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
