Glycoside
GD133803
Name:
2-(4-chlorophenoxy)-6-(iodomethyl)oxane-3,4,5-triolFormula:
C13H14O5ClISmiles:
OC1C(CI)OC(Oc2ccc(Cl)cc2)C(O)C1OAglycone:
Oc1ccc(Cl)cc1Sugarmoiety:
OC1OC(CI)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 3 |
| MolWt: | 400.6 | Num_heavy_atoms: | 19 |
| TPSA: | 79.15 | NumAromaticRings: | 1 |
Unique Aglycone
AD12677
Formula: C7H5OCl
Smiles:
Oc1ccc(Cl)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 0 |
| MolWt: | 128.56 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
