General Information of the Compound
| Compound ID |
CP0435275
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(2-((2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yloxy)phenyl)-3-phenylpropan-1-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H22O6
|
||||||||||||||||||
| Molecular Weight |
358.39
|
||||||||||||||||||
| Canonical SMILES |
OC[C@H]1O[C@@H](Oc2ccccc2C(=O)CCc2ccccc2)[C@H](O)[C@@H]1O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H22O6/c21-12-17-18(23)19(24)20(26-17)25-16-9-5-4-8-14(16)15(22)11-10-13-6-2-1-3-7-13/h1-9,17-21,23-24H,10-12H2/t17-,18-,19-,20-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZTNCCJMTVBEUQZ-UAFMIMERSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound