General Information of the Compound
| Compound ID |
CP0727407
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-Hydroxy-6-methoxy-2-((E)-styryl)-chroman-4-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H16O4
|
||||||||||||||||||
| Molecular Weight |
296.322
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc2c(c1)C(=O)C(O)C(/C=C/c1ccccc1)O2
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H16O4/c1-21-13-8-10-15-14(11-13)17(19)18(20)16(22-15)9-7-12-5-3-2-4-6-12/h2-11,16,18,20H,1H3/b9-7+
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZUVYPUCXQZJIJC-VQHVLOKHSA-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