Molecule

ID:53043

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₄O₇
Molecular Mass
304.33616
Exact Mass
304.15220311
Charge
0
InChI
InChI=1S/C14H24O7/c1-4-12(15)18-8-7-11(9-19-13(16)5-2)20-10-21-14(17)6-3/h11H,4-10H2,1-3H3
InChIKey
LTDCHYWWHJBKKM-UHFFFAOYSA-N
Canonic Smiles
CCC(=O)OCC(OCOC(=O)CC)CCOC(=O)CC
Isomeric Smiles
CCC(=O)OCC(OCOC(=O)CC)CCOC(=O)CC
Calculated Properties
JChem
H Acceptors
4
H Donor
0
LogD (pH = 5.5)
1.709055
LogD (pH = 7.4)
1.709055
Log P
1.709055
Molar Refractivity
72.5697
Polarizability
29.642904
Polar Surface Area
88.13
Rotatable Bonds
14
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Bioactivity
Navigation