General Information of the Compound
| Compound ID |
CP0668776
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
7-methoxymethoxy-15,18,18-trimethyl-(1S,5S)-2,4,12-trioxatetracyclo[12.3.1.01,5.06,11]octadeca-6(11),7,9,14-tetraen-3-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H24O6
|
||||||||||||||||||
| Molecular Weight |
360.406
|
||||||||||||||||||
| Canonical SMILES |
COCOc1cccc2c1[C@@H]1OC(=O)O[C@]13CCC(C)=C(CO2)C3(C)C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H24O6/c1-12-8-9-20-17(25-18(21)26-20)16-14(23-10-13(12)19(20,2)3)6-5-7-15(16)24-11-22-4/h5-7,17H,8-11H2,1-4H3/t17-,20+/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
XYIUNKCLFZSCAY-FXAWDEMLSA-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