Molecule

ID:9411

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₆O₆
Molecular Mass
290.35264
Exact Mass
290.17293855
Charge
0
InChI
InChI=1S/C14H26O6/c1-3-17-9-11-19-13(15)7-5-6-8-14(16)20-12-10-18-4-2/h3-12H2,1-2H3
InChIKey
NJEMMCIKSMMBDM-UHFFFAOYSA-N
Canonic Smiles
CCOCCOC(=O)CCCCC(=O)OCCOCC
Isomeric Smiles
C(OC(=O)CCCCC(=O)OCCOCC)COCC
Calculated Properties
JChem
H Acceptors
4
H Donor
0
LogD (pH = 5.5)
1.4021074
LogD (pH = 7.4)
1.4021074
Log P
1.4021074
Molar Refractivity
73.8614
Polarizability
29.507332
Polar Surface Area
71.06
Rotatable Bonds
15
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