Chemical ID: 4566427

CCc1cc2c(cc1OC(=O)c3cccc(c3)OC)occ(c2=O)c4ccc5c(c4)OCCO5
Chemical ID:
4566427
Name [?]:
[3-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-yl)-6-ethyl-4-oxo-chromen-7-yl] 3-methoxybenzoate
SMILES [?]:
CCc1cc2c(cc1OC(=O)c3cccc(c3)OC)occ(c2=O)c4ccc5c(c4)OCCO5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H22O7
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:11.1068
Area:681.564
Solvation:-5.93228
Coulombic:-59.6243
Bond Count [?]
All:38
Single:26
Double:12
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:458.459
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:5.26
LogP (Chemaxon):5.01

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue