General Information of the Compound
| Compound ID |
CP0442018
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(3,4-Dihydroxy-phenyl)-5-hydroxy-7-methoxy-6-tetradecyloxy-chromen-4-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H40O7
|
||||||||||||||||||
| Molecular Weight |
512.643
|
||||||||||||||||||
| Canonical SMILES |
CCCCCCCCCCCCCCOc1c(OC)cc2oc(cc(=O)c2c1O)-c1ccc(O)c(O)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H40O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-36-30-27(35-2)20-26-28(29(30)34)24(33)19-25(37-26)21-15-16-22(31)23(32)18-21/h15-16,18-20,31-32,34H,3-14,17H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
LOXZEOGUUUPXNH-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