General Information of the Compound
| Compound ID |
CP0548170
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2,8-dioxo-6-(4-propan-2-ylphenyl)pyrano[2,3-f]chromene-3,9-dicarboxylic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H16O8
|
||||||||||||||||||
| Molecular Weight |
420.373
|
||||||||||||||||||
| Canonical SMILES |
CC(C)c1ccc(cc1)-c1cc2cc(C(O)=O)c(=O)oc2c2cc(C(O)=O)c(=O)oc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H16O8/c1-10(2)11-3-5-12(6-4-11)14-7-13-8-16(20(24)25)22(28)30-18(13)15-9-17(21(26)27)23(29)31-19(14)15/h3-10H,1-2H3,(H,24,25)(H,26,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
AOYPPKYSYHPZRI-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