General Information of the Compound
| Compound ID |
CP0567095
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-[(4-acetyloxyphenyl)methoxyamino]-2-[(4-ethoxycarbonylphenyl)methyl]-5-oxopentanoic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H27NO8
|
||||||||||||||||||
| Molecular Weight |
457.479
|
||||||||||||||||||
| Canonical SMILES |
CCOC(=O)c1ccc(CC(CCC(=O)NOCc2ccc(OC(C)=O)cc2)C(O)=O)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H27NO8/c1-3-31-24(30)19-8-4-17(5-9-19)14-20(23(28)29)10-13-22(27)25-32-15-18-6-11-21(12-7-18)33-16(2)26/h4-9,11-12,20H,3,10,13-15H2,1-2H3,(H,25,27)(H,28,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
VRXBHERAAJKERJ-UHFFFAOYSA-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