Molecule

ID:104472

General Information
Structure
MolImage
Molecular Formula
C₃₄H₆₆O₂
Molecular Mass
506.88664
Exact Mass
506.50628135
Charge
0
InChI
InChI=1S/C34H66O2/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-33-36-34(35)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h17-18H,3-16,19-33H2,1-2H3
InChIKey
ZCVXZRVTVSAZJS-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCC(=O)OCCCCCCCC/C=C/CCCCCCCC
Isomeric Smiles
CCCCCCCCCCCCCCCC(=O)OCCCCCCCC/C=C/CCCCCCCC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
13.588415
LogD (pH = 7.4)
13.588415
Log P
13.588415
Molar Refractivity
161.2569
Polarizability
63.965683
Polar Surface Area
26.3
Rotatable Bonds
31
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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