Molecule

ID:131617

General Information
Structure
MolImage
Molecular Formula
C₃₂H₆₂O₃
Molecular Mass
494.83288
Exact Mass
494.46989584
Charge
0
InChI
InChI=1S/C32H62O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31(33)35-32(34)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-30H2,1-2H3
InChIKey
QWZBEFCPZJWDKC-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCCCC
Isomeric Smiles
CCCCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCCCC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
12.647338
LogD (pH = 7.4)
12.647338
Log P
12.647338
Molar Refractivity
150.9618
Polarizability
60.540977
Polar Surface Area
43.37
Rotatable Bonds
30
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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