General Information of the Compound
| Compound ID |
CP0490303
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2S,3R,4R,5S,6R)-2-[4-chloro-3-[(4-methoxynaphthalen-1-yl)methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H25ClO6
|
||||||||||||||||||
| Molecular Weight |
444.911
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(Cc2cc(ccc2Cl)[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2ccccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H25ClO6/c1-30-19-9-7-13(16-4-2-3-5-17(16)19)10-15-11-14(6-8-18(15)25)24-23(29)22(28)21(27)20(12-26)31-24/h2-9,11,20-24,26-29H,10,12H2,1H3/t20-,21-,22+,23-,24+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZNZLHKMRPIURHE-SJSRKZJXSA-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